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3-(4-Methylphenyl)propanoic Acid | 1505-50-6

Product name:3-(4-Methylphenyl)propanoic Acid

CAS No:1505-50-6
MF:C10H12O2
MW:164.2011
MDL:MFCD00016561
CID:41494
PubChem ID:73927
Names and Identifiers
  • 3-(p-Tolyl)propanoic acid
  • 3-(p-Tolyl)-propionic acid
  • 4-Methylhydrocinnamic acid~3-(p-Tolyl)propionic acid
  • 3-(p-Tolyl)propionic Acid
  • 3-(4-METHYLPHENYL)PROPIONIC ACID
  • 3-(4-METHYLPHENYL)PROPANOIC ACID
  • 3-P-TOLYLPROPANOIC ACID
  • 4-p-Tolyl-propionic acid
  • 3-(4-Tolyl)propionic acid
  • 4-METHYLHYDROCINNAMIC ACID
  • P-METHYLHYDROCINNAMIC ACID
  • B-(P-TOLYL)-PROPIONIC ACID
  • 4-METHYLPHENYLPROPIONIC ACID
  • BETA-(P-TOLYL)PROPIONIC ACID
  • OTAVA-BB BB7018760318
  • Benzenepropanoic acid, 4-methyl-
  • 4-methyl phenyl propionic acid
  • LDYGRLNSOKABMM-UHFFFAOYSA-N
  • zlchem 777
  • PubChem3031
  • ss-p-Toluylpropionsaure
  • 2ay4
  • 3-p-tolylpropionic acid
  • 3-(4-Methylphenyl)propionic Acid
  • 3-(p-Tolyl)propionic acid
  • 3-(P-TOLYL)PROPIONIC ACID
  • p-Methylhydrocinnamic acid
  • FT-0613873
  • FS-1553
  • CS-W013244
  • 3-(p-Tolyl)propionicacid
  • 3-(4-methyphenyl)propionic acid
  • UNII-BG327JNM0V
  • T2797
  • 3-(4-Methylphenyl)propanoic acid #
  • NS00024918
  • 3-(4-Methylphenyl)propionic acid
  • EINECS 216-132-9
  • Maybridge3_000616
  • A809053
  • AB01198
  • 3-p-tolylpropanoic acid
  • HMS1432L22
  • AMY3841
  • DB03400
  • 1505-50-6
  • 3-(p-Tolyl)propionic acid, 98%
  • 3-(p-tolyl)propanoate
  • 4-Methylhydrocinnamic Acid
  • AKOS000112347
  • SCHEMBL169770
  • InChI=1/C10H12O2/c1-8-2-4-9(5-3-8)6-7-10(11)12/h2-5H,6-7H2,1H3,(H,11,12
  • Q27094334
  • SY007830
  • 4-methylphenylpropionic acid
  • Z169855336
  • PD007021
  • EN300-24184
  • CHEMBL1235413
  • F3099-6432
  • NSC 512
  • 4-METHYL-BENZENEPROPANOIC ACID
  • DTXSID70164562
  • NSC-512
  • IDI1_012003
  • 3-(4-Methylphenyl)propanoic acid
  • 4-methylbenzenepropanoic acid
  • BG327JNM0V
  • NSC512
  • MFCD00016561
  • W-108074
  • P-(METHYLPHENYL)PROPANOIC ACID
  • MDL:MFCD00016561
  • InChIKey:LDYGRLNSOKABMM-UHFFFAOYSA-N
  • Inchi:1S/C10H12O2/c1-8-2-4-9(5-3-8)6-7-10(11)12/h2-5H,6-7H2,1H3,(H,11,12)
  • SMILES:O([H])C(C([H])([H])C([H])([H])C1C([H])=C([H])C(C([H])([H])[H])=C([H])C=1[H])=O
  • BRN:2046164
Chemical and Physical Properties

Computed Properties

  • Exact Mass: 164.08400
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Rotatable Bond Count: 3
  • Monoisotopic Mass: 164.084
  • Heavy Atom Count: 12
  • Complexity: 146
  • 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
  • XLogP3: 2.2
  • Tautomer Count: nothing
  • Surface Charge: 0
  • Topological Polar Surface Area: 37.3

Experimental Properties

  • LogP: 2.01220
  • PSA: 37.30000
  • Boiling Point: 290.6±9.0 ℃ at 760 mmHg
  • Melting Point: 114.0 to 118.0 deg-C
  • Flash Point: 187.7℃
  • Solubility: Soluble in methanol.
  • Color/Form: Powder.
  • Solubility: Not determined
  • Density: 1.097
Security Information
  • Symbol: GHS07
  • WGK Germany:3
  • Safety Term:S26;S36
  • Safety Instruction:S26-S36
  • Risk Phrases:R36/37/38
  • Dấu hiệu hàng nguy hiểm: Xi Xi
  • Hazardous Material transportation number:NONH for all modes of transport
  • Hazard Statement:H315-H319
  • Warning Statement:P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
  • Prompt:warning
  • Hazard Category Code:36/37/38
  • Signal Word:Warning
  • HazardClass:IRRITANT
Customs Data
  • HS CODE:2916399090
  • Customs Data:

    China Customs Code:

    2916399090

    Overview:

    2916399090 Other aromatic monocarboxylic acids. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, Acrylic acid\Acrylates or esters shall be packaged clearly

    Summary:

    2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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