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Substance Name: DL-Isoleucine
RN: 443-79-8
UNII: 5HX0BYT4E3
InChIKey: AGPKZVBTJJNPAG-WHFBIAKZSA-N

Molecular Formula

  • C6-H13-N-O2

Molecular Weight

  • 131.1737
 
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Names and Synonyms

Results Name

  • DL-Isoleucine

Name of Substance

  • Isoleucine, DL-

Synonyms

  • 2-Amino-3-methylpentanoic acid
  • 2-Amino-3-methylvaleric acid
  • AI3-18474
  • alpha-Amino-beta-methylvaleric acid
  • DL-Isoleucine
  • EINECS 207-139-8
  • FEMA No. 3295
  • NSC 9958
  • UNII-5HX0BYT4E3

Systematic Names

  • DL-Allo-isoleucine
  • Isoleucine

Superlist Name

  • Isoleucine, DL-

Registry Numbers

CAS Registry Number

  • 443-79-8

FDA UNII

  • 5HX0BYT4E3

Other Registry Numbers

  • 1160211-67-5
  • 1649424-38-3
  • 1798874-13-1
  • 198412-80-5
  • 19883-67-1
  • 205879-85-2
  • 224311-99-3
  • 228416-77-1
  • 676371-21-4

System Generated Number

  • 0000443798

Structure Descriptors

InChI

1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1

InChIKey

AGPKZVBTJJNPAG-WHFBIAKZSA-N

Smiles

CC[C@H](C)[C@H](N)C(=O)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -1.590 (none)   EST
Water Solubility 2.23E+04 mg/L 25 EXP
Atmospheric OH Rate Constant 4.26E-11 cm3/molecule-sec 25 EST

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