AG003ABT

1073666-54-2 | (S)-3-Aminobutanenitrile hydrochloride

AG003ABT

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CAS Number	1073666-54-2
Catalog Number	AG003ABT(AGN-PC-0WALS4)
Chemical Name	(S)-3-Aminobutanenitrile hydrochloride
IUPAC Name	(3S)-3-aminobutanenitrile;hydrochloride
InChI	InChI=1S/C4H8N2.ClH/c1-4(6)2-3-5;/h4H,2,6H2,1H3;1H/t4-;/m0./s1
InChI Key	YUOMYYHJZHVWDF-WCCKRBBISA-N
MDL Number	MFCD18651598
Molecular Formula	C4H9ClN2
Molecular Weight	120.5807
SMILES	Cl.N[C@H](CC#N)C
Synonyms	(S)-3-Aminobutanenitrile hydrochloride, 1073666-54-2, (S)-3-AMINOBUTANENITRILE HCL, AK173140, KS-00000T2D, MFCD18651598, AKOS025396650, AS-30133, AX8274705, (S)-3-AMINOBUTANENITRILE-HCl, ACN-054739, (S)-3-Aminobutanenitrile hydrochloride, 97% - 1G 1g,

Complexity	68.9
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	120.045g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	120.58g/mol
Monoisotopic Mass	120.045g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	49.8A^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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