AG00174D

1223405-15-9 | N-Me-Aib-OH HCl

AG00174D

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CAS Number	1223405-15-9
Catalog Number	AG00174D(AGN-PC-0WNOJQ)
Chemical Name	N-Me-Aib-OH HCl
IUPAC Name	2-methyl-2-(methylamino)propanoic acid;hydrochloride
InChI	InChI=1S/C5H11NO2.ClH/c1-5(2,6-3)4(7)8;/h6H,1-3H3,(H,7,8);1H
InChI Key	BZLVPSLGJCWYBB-UHFFFAOYSA-N
MDL Number	MFCD06795786
Molecular Formula	C5H12ClNO2
Molecular Weight	153.6073
SMILES	Cl.CC(C(=O)O)(C)NC
Synonyms	2-methyl-2-(methylamino)propanoic acid hydrochloride, 1223405-15-9, N-ME-AIB-OH HCL, SCHEMBL2240887, BZLVPSLGJCWYBB-UHFFFAOYSA-N, methyl 2-methylalanine hydrochloride, 5084AH, Alanine, N,2-dimethyl-, hydrochloride (1:1), K-6707, C5H11NO2.HCl, 2-(Methylamino)isobutyric acid, 2566-34-9, 2-(Methylamino)isobutyric acid hydrochloride, 98.5% - 1G 1g,

Complexity	98.6
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	153.056g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	153.606g/mol
Monoisotopic Mass	153.056g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	49.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

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