AG00336W

19481-82-4 | 2-Bromopropionitrile

AG00336W

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CAS Number	19481-82-4
Catalog Number	AG00336W(AGN-PC-0J7I3K)
Chemical Name	2-Bromopropionitrile
IUPAC Name	2-bromopropanenitrile
InChI	InChI=1S/C3H4BrN/c1-3(4)2-5/h3H,1H3
InChI Key	PYNYHMRMZOGVML-UHFFFAOYSA-N
MDL Number	MFCD00010383
Molecular Formula	C3H4BrN
Molecular Weight	133.9746
SMILES	BrC(C#N)C
Synonyms	2-Bromopropionitrile, 2-bromopropanenitrile, 19481-82-4, Propanenitrile, 2-bromo-, Propanenitrile, bromo-, 2-bromopropanitrile, 2-bromoproprionitrile, 2-bromo-propionitrile, AC1Q1LDI, ACMC-1BO3L, (+) 2-bromo-propionitrile, 2-Bromopropionitrile, 97%, (+/-)-2-Bromopropionitrile, SCHEMBL181237, AC1L3H69, CTK4E1627, Propanenitrile,2-bromo- (9CI), PYNYHMRMZOGVML-UHFFFAOYSA-N, MFCD00010383, AKOS015912645, NE10684, KS-0000194A, SC-48220, DB-044871, TX-016340, FT-0637857, ST24040222, X7909, 2-BROMOPROPIONITRILE; 2-BROMOPROPIONITRILE, R801736, J-508540, I14-48647, BROMOPROPIONITRILE, C3H4BrN, CID140538,

Complexity	60.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	132.953g/mol
Formal Charge	0
Heavy Atom Count	5
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	133.976g/mol
Monoisotopic Mass	132.953g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	23.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H226-H302+H312+H332-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P305+P351+P338
UN Code	UN 1993

Certificate of Analysis

Lot Number