CAS Registry Number®
181289-15-6
CAS Name
3-(Carbamoylmethyl)-5-methylhexanoic acid
Molecular Formula
C9H17NO3
Molecular Mass
187.24
Compound Properties
-
Melting Point (1)
108-110 °C
Source(s)
- (1) Chavan, Anil B.; Organic Process Research & Development, (2009), 13(4), 812-814, CAplus
Other Names and Identifiers
InChI
InChI=1S/C9H17NO3/c1-6(2)3-7(4-8(10)11)5-9(12)13/h6-7H,3-5H2,1-2H3,(H2,10,11)(H,12,13)
InChIKey
InChIKey=NPDKTSLVWGFPQG-UHFFFAOYSA-N
SMILES
C(CC(C)C)(CC(N)=O)CC(O)=O
Canonical SMILES
O=C(O)CC(CC(=O)N)CC(C)C
Other Names for this Substance
- Hexanoic acid, 3-(2-amino-2-oxoethyl)-5-methyl-
- 3-(2-Amino-2-oxoethyl)-5-methylhexanoic acid
- 3-(Carbamoylmethyl)-5-methylhexanoic acid
