1. chem960
  2. 518-82-1
Emodin | 518-82-1

Product name:Emodin

CAS No:518-82-1
MF:C15H10O5
MW:270.2369
MDL:MFCD00001207
CID:37962
PubChem ID:3220
Introduction
        Emodin(Emodin)It is the dry rhizome and root of Polygonum cuspidatum.Rhizome of Rheum palmatum,Plant type medicament.The physiological activity of emodin determines that it can not only be used in medical treatment,It can also be used in health care and household chemicals,If someone uses it in hair care and skin care products,It has also been incorporated into natural pigments. abroad,People use it as a laxative.
Names and Identifiers
  • Emodin
  • 1,3,8-Trihydroxy-6-methylanthraquinone
  • 6-Methyl-1,3,8-trihydroxyanthraquinone
  • emodin from frangula bark
  • 2-CHLOROPYRIDINE-3-BORONIC ACID
  • EMODIN(P)
  • EMODIN(P) PrintBack
  • EMODIN(RG)
  • Frangula emodin
  • 1,3,8-trihydroxy-6-methyl-9,10-anthraquinone
  • 1,3,8-TRIHYDROXY-6-METHYL-9-10-ANTHRACENEDIONE
  • 1,3,8-Trihydroxy-6-methylanthracene-9,10-dione
  • 1,3,8-Tri-hydroxy-6-methyl-anthra-quinone
  • Alatinone
  • Archin
  • Ecdyson
  • Emdin
  • EMODIN 99
  • EMODINE
  • EMODOL
  • schuttgelb
  • 1,3,8-Trihydroxy-6-methyl-9,10-anthracenedione
  • 1,3,8-Tri­hydroxy-6-methyl­anthra­quinone
  • 6-Methyl-1,3,8-tri­hydroxy­anthra­quinone
  • Frangula-emodin
  • Frangulic acid
  • Rheum emodin
  • C.I. 75440
  • C.I. Natural Yellow 14
  • [ "1", "3", "8-Trihydroxy-6-methylanthraquinone" ]
  • 1
  • 3-Methyl-1,6,8-trihydroxyanthraquinone
  • Persian Berry Lake
  • 9,10-Anthracenedione, 1,3,8-trihydroxy-6-methyl-
  • 4,5,7-Trihydroxy-2-methylanthraquinone
  • NS
  • MLS000563068
  • ConMedNP.2906
  • 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE
  • MLS001066370
  • Schuttgelb
  • 1,3,8-trihydroxy-6-methyl-9,10-anthracenedione
  • 1,3,8-Trihydroxy 6-methyl 9,10-anthraquinone
  • Dataset-S1.56
  • MLS004257392
  • SMR000326798
  • MLSMR
  • MLS006011712
  • ConMedNP.2907
  • 518-82-1
  • ConMedNP.2908
  • Giant knotweed emodin
  • MDL:MFCD00001207
  • InChIKey:RHMXXJGYXNZAPX-UHFFFAOYSA-N
  • Inchi:1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3
  • SMILES:O([H])C1=C([H])C(C([H])([H])[H])=C([H])C2C(C3C([H])=C(C([H])=C(C=3C(C=21)=O)O[H])O[H])=O
Chemical and Physical Properties

Computed Properties

  • Exact Mass: 270.24g/mol
  • Surface Charge: 0
  • XLogP3: 2.7
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 5
  • Rotatable Bond Count: 0
  • Monoisotopic Mass: 270.052823g/mol
  • Monoisotopic Mass: 270.052823g/mol
  • Topological Polar Surface Area: 94.8Ų
  • Heavy Atom Count: 20
  • Complexity: 434
  • Isotope Atom Count: 0
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Covalently-Bonded Unit Count: 1
  • Topological Polar Surface Area: 94.8
  • Formal charge: 0
  • Functional 3D Acceptor Count: 2
  • Functional 3D ring Count: 3
  • Rotatable Bond Count: 0
  • isomeric RMSD: 0.6
  • CID conformational isomer Count: 1
  • Tautomer Count: 135
  • Surface Charge: 0
  • Functional 3D Donor Count: 3

Experimental Properties

  • Odor: Orange crystals
  • Stability Shelf Life: This chemcial may be sensitive to prolonged exposure to light. Solns of this chemical in water, DMSO, 95% ethanol or acetone should be stable for 24 hr under normal lab conditions (RAD).
  • Decomposition: When heated to decomp it emits acrid smoke and irritating fumes.
  • LogP: 1.88720
  • PSA: 94.83000
  • Merck: 3561
  • Refractive Index: 1.5000 (estimate)
  • Water Partition Coefficient: <0.1 g/100 mL at 19 ºC
  • Flash Point: 322.8 °C
  • Solubility: Soluble in ethanol, slightly soluble in ether, chloroform, benzene, insoluble in water. Soluble in caustic soda aqueous solution and sodium carbamate aqueous solution, showing cherry red color in ammonia solution
  • Sensitiveness: Light,Air sensitive
  • Density: 1.3280 (rough estimate)
  • Odor: Orange crystals
Security Information
  • Symbol: GHS07
  • RTECS:CB7920600
  • WGK Germany:3
  • Safety Term:S26;S37/39
  • Safety Instruction:S26-S36-S37/39
  • Risk Phrases:R36/37/38
  • Tanda barang berbahaya: Xi Xi
  • Hazardous Material transportation number:NONH for all modes of transport
  • Hazard Statement:H315,H319,H335
  • Warning Statement:P261,P305+P351+P338
  • Prompt:warning
  • Storage Condition:Powder -20°C 3 years   4°C 2 years In solvent -80°C 6 months   -20°C 1 month
  • Hazard Category Code:36/37/38
  • Signal Word:Warning
  • FLUKA BRAND F CODES:8-10-23
Customs Data
  • Customs Data:

    China Customs Code:

    2914690090

    Overview:

    2914690090 Other Quinones. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%

    Summary:

    2914690090 other quinones.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:5.5%.General tariff:30.0%

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CS-1412-200mg 99.39% In-stock 200mg $143.0/ ¥1,038.64 27 Apr. 2022
CS-1412-100mg 99.39% In-stock 100mg $77.0/ ¥559.27 27 Apr. 2022
CS-1412-50mg 99.39% In-stock 50mg $55.0/ ¥399.48 27 Apr. 2022
CS-1412-100g 99.39% Backordered 100g $375.0/ ¥2,723.70 02 Sep. 2021
CS-1412-25g 99.39% In-stock 25g $103.0/ ¥748.11 02 Sep. 2021
CS-1412-10g 99.39% In-stock 10g $56.0/ ¥406.74 02 Sep. 2021
Brand:chemfaces Supplier:ChemFaces
No. Purity Stock Specification Price update time operate
CFN98834-20mg >=98% 20mg $30/ ¥217.90 19 Sep. 2023
CFN98834-20mg >=98% 20mg $30/ ¥217.90 22 Jul. 2021
Brand:安捷凯 Supplier:武汉安捷凯生物医药科技有限公司
No. Purity Stock Specification Price update time operate
ajci16330-200mg 98% 现货 200mg ¥718.00 09 Sep. 2023
ajci16330-100mg 98% 现货 100mg ¥416.00 09 Sep. 2023
Brand:Acmec Supplier:上海吉至生化科技有限公司
No. Purity Stock Specification Price update time operate
E59750-25g 98% 现货 25g ¥858.0 09 Sep. 2021
E59750-1g 98% 7个工作日 1g ¥98.0 15 Feb. 2023
E59750-5g 98% 现货 5g ¥178.0 07 Sep. 2023
E59751-200mg 现货 200mg ¥458.0 09 Sep. 2021
E59751-100mg 现货 100mg ¥278.0 09 Sep. 2021
E59751-20mg 20mg ¥78.0 09 Sep. 2021
Brand:trc Supplier:TRC
No. Purity Stock Specification Price update time operate
E523000-1g 0.0 1g $623.00/ ¥4,524.97 18 May. 2023
E523000-250mg 0.0 250mg $210.00/ ¥1,525.27 18 May. 2023
E523000-100mg 0.0 100mg $ 91.00/ ¥660.95 07 Sep. 2023
E523000-50mg 0.0 50mg $ 64.00/ ¥464.84 07 Sep. 2023
E523000-25mg 0.0 25mg $ 51.00/ ¥370.42 07 Sep. 2023
Brand:astate Supplier:AstaTech
No. Purity Stock Specification Price update time operate
21452-100/G 97% Please enter Qty to check availability 100g $680/ ¥4,938.98 18 Sep. 2023
21452-25/G 97% Please enter Qty to check availability 25g $272/ ¥1,975.59 18 Sep. 2023
21452-5/G 97% Please enter Qty to check availability 5g $91/ ¥660.95 18 Sep. 2023
Brand:selleck Supplier:Selleck中国
No. Purity Stock Specification Price update time operate
S2295-50mg 99.75% 现货 50mg ¥647.01 16 Sep. 2023
S2295-10mM (1mL in DMSO) 99.75% 现货 10mM (1mL in DMSO) ¥567.53 16 Sep. 2023
Brand:bomeibio Supplier:合肥博美生物科技有限责任公司
No. Purity Stock Specification Price update time operate
BZP0044-20mg HPLC≥98% 现货 20mg ¥90元 15 Sep. 2023
Brand:aladdin Supplier:上海阿拉丁生化科技股份有限公司
No. Purity Stock Specification Price update time operate
E106693-100mg 分析标准品,≥96.0% (HPLC) 现货 100mg ¥247.90 03 Sep. 2023
E106693-50mg 分析标准品,≥96.0% (HPLC) 现货 50mg ¥148.90 03 Sep. 2023
E106693-20mg 分析标准品,≥96.0% (HPLC) 现货 20mg ¥85.90 03 Sep. 2023
E106693-1g 分析标准品,≥96.0% (HPLC) 现货 1g ¥1568.90 03 Sep. 2023
Brand:fluorochem Supplier:Fluorochem
No. Purity Stock Specification Price update time operate
032376-25g 95% < 4 weeks 25g £117.00/ ¥975.10 01 Mar. 2022
032376-10g 95% 2 10g £59.00/ ¥491.72 01 Mar. 2022
032376-5g 95% 4 5g £34.00/ ¥283.36 01 Mar. 2022
032376-1g 95% > 10 1g £11.00/ ¥91.68 01 Mar. 2022
Brand:a2bchem Supplier:A2B Chem LLC
No. Purity Stock Specification Price update time operate
AI51608-25g 98% in stock 25g $71.00/ ¥515.69 30 Dec. 2023
AI51608-5g 98% in stock 5g $23.00/ ¥167.05 30 Dec. 2023
AI51608-1g 98% in stock 1g $9.00/ ¥65.37 30 Dec. 2023
AI51608-250mg 98% in stock 250mg $7.00/ ¥50.84 30 Dec. 2023
AI51608-50mg 98% in stock 50mg $5.00/ ¥36.32 30 Dec. 2023
AI51608-1mg 98% in stock 1mg $4.00/ ¥29.05 30 Dec. 2023
Brand:1pchem Supplier:1PlusChem
No. Purity Stock Specification Price update time operate
1P00I9Q0-25g 98% In Stock USA 25g $81.00/ ¥588.32 16 Dec. 2023
1P00I9Q0-5g 98% In Stock USA 5g $26.00/ ¥188.84 16 Dec. 2023
1P00I9Q0-1g 98% In Stock USA 1g $10.00/ ¥72.63 16 Dec. 2023
1P00I9Q0-250mg 98% In Stock USA 250mg $8.00/ ¥58.11 16 Dec. 2023
1P00I9Q0-1mg 98% In Stock USA 1mg $4.00/ ¥29.05 16 Dec. 2023
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