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  2. 63493-28-7
pentan-2-amine | 63493-28-7

Product name:pentan-2-amine

CAS No:63493-28-7
MF:C5H13N
MW:87.1634
MDL:MFCD00008098
CID:58042
PubChem ID:12246
Names and Identifiers
  • ()-1-methylbutylamine
  • -AMINOPENTANE
  • 2-PENTYLAMINE
  • 1-METHYLBUTYLAMINE
  • RARECHEM AN KC 0232
  • 2-pentanamine
  • 2-Aminopentane
  • 1-methyl-butylamine hydrochloride
  • 2-Aminopentan
  • 2-AMYLAMINE
  • sec-pentylamine
  • pentan-2-amine
  • sec-Amylamine
  • 1-Methyl-n-butylamine
  • Butylamine, 1-methyl-
  • DL-2-Aminopentane
  • Methylpropylcarbinylamine
  • 1-methyl-butylamine
  • IGEIPFLJVCPEKU-UHFFFAOYSA-N
  • (R)(-)-2-AMINOPENTANE
  • sec-Pentanamine
  • 1-methylbutyl amine
  • (1-methylbutyl)amine
  • .alpha.-Methylbutylamine
  • (1)-1-Me
  • 2-Pentylamine
  • 2-Amylamine
  • QH0285API3
  • NSC 6367
  • NSC6367
  • DTXSID50870715
  • NS00056818
  • UNII-QH0285API3
  • 41444-43-3
  • A1102
  • AKOS017278377
  • 63493-28-7
  • (+/-)-2-aminopentane
  • STR08408
  • EINECS 255-366-6
  • MFCD00008098
  • (1)-1-Methylbutylamine
  • AKOS000120402
  • 2-Aminopentane, 97%
  • 2-AMINOPENTANE
  • Q5651245
  • EN300-20287
  • FT-0611257
  • NSC-6367
  • 2-Pentanamine
  • sec-Pentylamine
  • InChI=1/C5H13N/c1-3-4-5(2)6/h5H,3-4,6H2,1-2H
  • 2-Pentanamine, (.+/-.)-
  • EINECS 264-269-8
  • EINECS 210-886-2
  • AMY12548
  • 625-30-9
  • FT-0611278
  • MDL:MFCD00008098
  • InChIKey:IGEIPFLJVCPEKU-UHFFFAOYSA-N
  • Inchi:1S/C5H13N/c1-3-4-5(2)6/h5H,3-4,6H2,1-2H3
  • SMILES:N([H])([H])C([H])(C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])[H]
  • BRN:635657
Chemical and Physical Properties

Computed Properties

  • Exact Mass: 87.10480
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Rotatable Bond Count: 2
  • Monoisotopic Mass: 87.105
  • Heavy Atom Count: 6
  • Complexity: 27.1
  • Isotope Atom Count: 0
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Covalently-Bonded Unit Count: 1
  • XLogP3: 1
  • Tautomer Count: nothing
  • Surface Charge: 0
  • Topological Polar Surface Area: 26

Experimental Properties

  • LogP: 1.83400
  • PSA: 26.02000
  • Refractive Index: n20/D 1.4020(lit.)
  • Boiling Point: 91°C
  • Flash Point: Fahrenheit: 95 ° f < br / > Celsius: 35 ° C < br / >
  • Color/Form: A colorless liquid resembling an amine
  • Solubility: Not determined
  • Density: 0.736 g/mL at 25 °C(lit.)
Security Information
  • Symbol: GHS02 GHS05
  • WGK Germany:3
  • Safety Term:3
  • Safety Instruction:S26; S36/37/39; S45
  • Packing Group:II
  • Risk Phrases:R10
  • Dangerous goods sign: C C
  • Hazardous Material transportation number:UN 1106 3/PG 3
  • Hazard Statement:H225-H314
  • Warning Statement:P210-P233-P240-P241+P242+P243-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P370+P378-P403+P235-P405-P501
  • Prompt:dangerous
  • PackingGroup:II
  • Hazard Category Code:10-34
  • Signal Word:Danger
  • HazardClass:3
Synthetic Circuit

Synthetic Circuit 1

Reaction Conditions
1.1 Reagents: Hydrogen ,  Phosphoric acid Catalysts: Rhodium ,  Molybdenum oxide Solvents: Water ;  6 h, pH 1.8, 70 bar, 100 °C
Reference
Rh-Catalyzed Hydrogenation of Amino Acids to Biobased Amino Alcohols: Tackling Challenging Substrates and Application to Protein Hydrolysates
Vandekerkhove, Annelies ; Claes, Laurens ; De Schouwer, Free; Van Goethem, Cedric ; Vankelecom, Ivo F. J.; et al, ACS Sustainable Chemistry & Engineering, 2018, 6(7), 9218-9228
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