AG0039IN

301665-60-1 | 1-benzyl-4-bromopiperidine

AG0039IN

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CAS Number	301665-60-1
Catalog Number	AG0039IN(AGN-PC-03LK9D)
Chemical Name	1-benzyl-4-bromopiperidine
IUPAC Name	1-benzyl-4-bromopiperidine
InChI	InChI=1S/C12H16BrN/c13-12-6-8-14(9-7-12)10-11-4-2-1-3-5-11/h1-5,12H,6-10H2
InChI Key	BIVWVMVLXIUILP-UHFFFAOYSA-N
MDL Number	MFCD16496496
Molecular Formula	C12H16BrN
Molecular Weight	254.1661
SMILES	C(C1=CC=CC=C1)N1CCC(CC1)Br
Synonyms	1-Benzyl-4-bromopiperidine, 301665-60-1, 1-Benzyl-4-bromo-piperidine, 1-Benzyl4-bromopiperidine, SCHEMBL2007231, BIVWVMVLXIUILP-UHFFFAOYSA-N, KS-000025KP, ZINC73652917, AKOS017549730, GS-0631, Piperidine, 4-bromo-1-(phenylmethyl)-, AM100644, AJ-121267, ST24037787, Z2283, C12H16BrN, ACN-037966,

Complexity	158
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	253.047g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	254.171g/mol
Monoisotopic Mass	253.047g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	3.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338-P235+P410
UN Code

Certificate of Analysis

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