AG002S3G

26177-44-6 | 4-Bromobenzylamine, HCl

AG002S3G

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CAS Number	26177-44-6
Catalog Number	AG002S3G(AGN-PC-0KK054)
Chemical Name	4-Bromobenzylamine, HCl
EC Number	247-503-3
IUPAC Name	(4-bromophenyl)methanamine;hydrochloride
InChI	InChI=1S/C7H8BrN.ClH/c8-7-3-1-6(5-9)2-4-7;/h1-4H,5,9H2;1H
InChI Key	BVYUYDBWQMSOKM-UHFFFAOYSA-N
MDL Number	MFCD00012860
Molecular Formula	C7H9BrClN
Molecular Weight	222.5101
SMILES	NCC1=CC=C(Br)C=C1.[H]Cl
Synonyms	4-Bromobenzylamine hydrochloride, 26177-44-6, (4-bromophenyl)methanamine hydrochloride, 4-Bromobenzylamine HCl, 4-BBA X HCL, 4-Bromobenzylamine, HCl, MFCD00012860, P-BROMOBENZYLAMINE HYDROCHLORIDE, Benzenemethanamine, 4-bromo-, hydrochloride, 4-bromo-benzylamine hydrochloride, EINECS 247-503-3, PubChem3751, ACMC-1CFRZ, 4-Bromo-N-methylaniline,hcl, KSC493K8N, SCHEMBL161528, AC1MC489, 4-bromobenzyl amine hydrochloride, CTK3J3586, DTXSID20180797, BVYUYDBWQMSOKM-UHFFFAOYSA-N, ACN-S003808, ACT01088, (4-bromophenyl)methanaminium chloride, (4-bromophenyl)methylamine, chloride, ANW-25912, AKOS008953606, 4-Bromobenzylamine hydrochloride, 98%, AS03103, MCULE-8952776735, PS-7819, RP27413, RTC-010095, TRA0051810, VZ28594, (4-bromophenyl)methanamine,hydrochloride, KS-00000O02, (4-bromophenyl) methanamine hydrochloride, (4-bromophenyl)methanamine, hydrochloride, AK-46356, BC002557, BR-46356, 1-(4-bromophenyl)methanamine hydrochloride, AB0020086, AB1003594, ST2402412, TC-010095, FT-0617874, ST50406408, V0839, EN300-34927, A-2788, 177B446, Benzenemethanamine, 4-bromo-, hydrochloride (1:1), J-016309, J-514811, null, C7H9BrClN, C7H8BrN.ClH, C7-H8-Br-N.Cl-H, 4-Bromobenzylaminehydrochloride, CID2724096, B1841,

Complexity	77
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	220.961g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	222.51g/mol
Monoisotopic Mass	220.961g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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