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Substance Name: 2-Butanamine, (S)-
RN: 513-49-5
UNII: Z192XWH21O
InChIKey: BHRZNVHARXXAHW-BYPYZUCNSA-N

Molecular Formula

  • C4-H11-N

Molecular Weight

  • 73.1379
 

Classification Codes

Classification Codes

  • Agricultural Chemical
  • Fungicide, Bactericide, Wood Preservative

Superlist Classification Code

  • Reportable Quantity (RQ) = 1000 lb
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Names and Synonyms

Name of Substance

  • 2-Butanamine, (S)-

Synonyms

  • (+)-2-Butylamine
  • (S)-2-Aminobutane
  • EINECS 208-164-7
  • S-2-Butylamine
  • UNII-Z192XWH21O

Systematic Names

  • (S)-sec-Butylamine
  • 2-Butanamine, (2S)-
  • 2-Butanamine, (S)- (9CI)

Superlist Names

  • sec-Butylamine
  • sec-Butylamine, (S)-

Registry Numbers

CAS Registry Number

  • 513-49-5

FDA UNII

  • Z192XWH21O

Other Registry Number

  • 776995-07-4

System Generated Number

  • 0000513495

Structure Descriptors

InChI

1S/C4H11N/c1-3-4(2)5/h4H,3,5H2,1-2H3/t4-/m0/s1

InChIKey

BHRZNVHARXXAHW-BYPYZUCNSA-N

Smiles

CC[C@H](C)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 oral 225mg/kg (225mg/kg)   "Pesticide Index," Frear, E.H., ed., State College, PA, College Science Pub., 1969Vol. 5, Pg. 33, 1976.
rabbit LD50 skin 2500mg/kg (2500mg/kg)   "Pesticide Index," Frear, E.H., ed., State College, PA, College Science Pub., 1969Vol. 5, Pg. 33, 1976.
rat LD50 oral 380mg/kg (380mg/kg)   "Pesticide Index," Frear, E.H., ed., State College, PA, College Science Pub., 1969Vol. 5, Pg. 33, 1976.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 62.5 deg C   EXP
pKa Dissociation Constant 10.56 (none)   EXP
log P (octanol-water) 0.74 (none)   EXP
Water Solubility 3.19E+05 mg/L 25 EST
Vapor Pressure 118 mm Hg 25 EST
Henry's Law Constant 1.77E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.47E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.