AG00EAPV

58610-42-7 | (R)-Homo-beta-alanine, HCl

AG00EAPV

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CAS Number	58610-42-7
Catalog Number	AG00EAPV(AGN-PC-0SQ4ZZ)
Chemical Name	(R)-Homo-beta-alanine, HCl
IUPAC Name	(3R)-3-aminobutanoic acid;hydrochloride
InChI	InChI=1S/C4H9NO2.ClH/c1-3(5)2-4(6)7;/h3H,2,5H2,1H3,(H,6,7);1H/t3-;/m1./s1
InChI Key	UHYVVUABAWKTJJ-AENDTGMFSA-N
MDL Number	MFCD06202382
Molecular Formula	C4H10ClNO2
Molecular Weight	139.5807
SMILES	C[C@@H](N)CC(O)=O.[H]Cl
Synonyms	58610-42-7, (R)-3-Aminobutanoic acid hydrochloride, (r)-homo-beta-alanine hydrochloride, (r)-3-amino-butyric acid hydrochloride, d-beta-homoalanine-hcl, (R)-HOMO-BETA-ALANINE HCL, d-beta-homoalanine hydrochloride, (r)-3-amino-butanoic acid hydrochloride salt, (r)-3-amino-butanoic acid hydrochloride, l-beta-homoalaninehydrochloride, D-?-Homoalanine hydrochloride, h-d-beta-hoala-oh hcl, h-d-ala-(c*ch2)oh hcl, R-3-Aminobutric acid HCL, (R)-Homo-beta-alanine, HCl, (R)--Homoalanine hydrochloride, SCHEMBL1661450, (R)-A-Homoalanine hydrochloride, butanoic acid, 3-amino-, hydrochloride (1:1), (3r)-, UHYVVUABAWKTJJ-AENDTGMFSA-N, (r)-beta-homoalanine hydrochloride, BCP11586, KS-00000LM1, CH-840, MFCD06202382, ACN-026129, GS-3449, RL04208, (3R)-3-aminobutyric acid;hydrochloride, (3R)-3-aminobutanoic acid;hydrochloride, (3R)-3-azanylbutanoic acid;hydrochloride, AC-22067, AK112818, M614, SC-44142, AB0015300, DB-038289, CS-0044025, FT-0683858, ST24035465, X-2563, (3R)-3-AMINOBUTANOIC ACID HYDROCHLORIDE, J-502253, I14-15257, l-beta-homoalanine hcl, C4H9NO2.HCl, beta-homoalanine hydrochloride, RW3827, -HOMO-BETA-ALANINEHYDROCHLORIDE, 58610-41-6, 5959-33-1,

Complexity	72.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	139.04g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	139.579g/mol
Monoisotopic Mass	139.04g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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