AG0033YA

3959-07-7 | 4-Bromobenzylamine

AG0033YA

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CAS Number	3959-07-7
Catalog Number	AG0033YA(AGN-PC-0JLQSE)
Chemical Name	4-Bromobenzylamine
EC Number	223-559-4
IUPAC Name	(4-bromophenyl)methanamine
InChI	InChI=1S/C7H8BrN/c8-7-3-1-6(5-9)2-4-7/h1-4H,5,9H2
InChI Key	XRNVSPDQTPVECU-UHFFFAOYSA-N
MDL Number	MFCD00047931
Molecular Formula	C7H8BrN
Molecular Weight	186.0491
SMILES	NCc1ccc(cc1)Br
Synonyms	4-Bromobenzylamine, 3959-07-7, (4-Bromophenyl)methanamine, p-Bromobenzylamine, 4-Bromo-benzylamine, Benzenemethanamine, 4-bromo-, 1-(4-Bromophenyl)methanamine, (4-bromophenyl)methylamine, XRNVSPDQTPVECU-UHFFFAOYSA-N, PZH, 4-bromobenzyl amine, PubChem23806, p-Bromobenzenemethanamine, AC1L2TCA, 4-Bromobenzylamine, 96%, AC1Q53WQ, AC1Q53WR, Benzenemethanamine, 4-bromo, Benzenemethanamine,4-bromo-, KSC492C7R, (4-Bromophenyl)methanamine #, SCHEMBL112119, 4-Bromobenzylaminehydrochloride, AMBZ0458, CHEMBL138621, CTK3J2178, DTXSID70192704, ZINC404752, AC1Q2656, ACN-S003823, EBD31366, KS-000002MV, EINECS 223-559-4, ANW-13855, MFCD00047931, SBB090347, STL185672, AKOS000128557, AM86931, AS02268, AS06970, CS-W007375, GS-3354, MCULE-1368263786, RP24603, RTR-036697, TRA0043450, AC-25942, AJ-22411, BC004974, BP-10081, BR-49170, P625, SC-12610, DB-000216, DB-031130, ST2418218, TR-036697, A5192, FT-0617873, FT-0659695, ST50406070, TL80090578, EN300-28537, A19816, M-7561, AE-562/43286501, (4-Bromophenyl)methanamine;p-Bromobenzenemethanamine, I01-6432, I01-6758, J-200169, F0001-1113, 64313-06-0, C7H8BrN, 4-Bromophenylacetic acid, (4-bromophenyl)methanamine hydrochloride, CID77571, AR-1G1270, 4-Bromobenzylamine, 98% - 1G 1g, R315, B4713, 26177-44-6, 1878-68-8, 4137-12-6,

Complexity	77
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	184.984g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	186.052g/mol
Monoisotopic Mass	184.984g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅱ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 2735

Certificate of Analysis

Lot Number