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Substance Name: Alloisoleucine, DL-
RN: 3107-04-8
UNII: 05T3WT3PJ1
InChIKey: AGPKZVBTJJNPAG-UHNVWZDZSA-N

Molecular Formula

  • C6-H13-N-O2

Molecular Weight

  • 131.1737
 
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Names and Synonyms

Name of Substance

  • Alloisoleucine, DL-

Synonyms

  • EINECS 221-464-2
  • UNII-05T3WT3PJ1

Systematic Name

  • Allo-DL-isoleucine

Registry Numbers

CAS Registry Number

  • 3107-04-8

FDA UNII

  • 05T3WT3PJ1

System Generated Number

  • 0003107048

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+/m1/s1

InChIKey

AGPKZVBTJJNPAG-UHNVWZDZSA-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 5.35E+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.