CAS Registry Number®
625120-81-2
CAS Name
N-Methyl-N-pentyl-β-alanine hydrochloride
Molecular Formula
C9H19NO2.ClH
Compound Properties
-
Melting Point (1)
97.0-98.5 °C
Source(s)
- (1) Reddy, V. V. R. M. Krishna; Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, (2010), 49B(9), 1257-1260, CAplus
Other Names and Identifiers
InChI
InChI=1S/C9H19NO2.ClH/c1-3-4-5-7-10(2)8-6-9(11)12;/h3-8H2,1-2H3,(H,11,12);1H
InChIKey
InChIKey=YDWXRULMHQZBEX-UHFFFAOYSA-N
SMILES
N(CCC(O)=O)(CCCCC)C.Cl
Canonical SMILES
Cl.O=C(O)CCN(C)CCCCC
Other Names for this Substance
- β-Alanine, N-methyl-N-pentyl-, hydrochloride (1:1)
- β-Alanine, N-methyl-N-pentyl-, hydrochloride
- Ibanic acid hydrochloride
- N-Methyl-N-pentyl-β-alanine hydrochloride
