AG00FB6Z

6911-87-1 | (4-Bromophenyl)methylamine

AG00FB6Z

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CAS Number	6911-87-1
Catalog Number	AG00FB6Z(AGN-PC-07H7UP)
Chemical Name	(4-Bromophenyl)methylamine
IUPAC Name	4-bromo-N-methylaniline
InChI	InChI=1S/C7H8BrN/c1-9-7-4-2-6(8)3-5-7/h2-5,9H,1H3
InChI Key	AYVPVDWQZAAZCM-UHFFFAOYSA-N
MDL Number	MFCD03030391
Molecular Formula	C7H8BrN
Molecular Weight	186.0491
SMILES	CNC1=CC=C(Br)C=C1
Synonyms	4-Bromo-N-methylaniline, 6911-87-1, 4-Bromo-N-methylbenzenamine, Benzenamine, 4-bromo-N-methyl-, N-methyl-4-bromoaniline, 4-Bromo-N-methylaniline, 97%, MFCD03030391, 211060-12-7, 4bromo-n-methylaniline, AC1MBUZ2, 4-bromo-N-methyl-aniline, N-methyl-4-bromo-aniline, ACMC-1CFC7, 4-bromanyl-N-methyl-aniline, SCHEMBL467157, (4-bromo-phenyl)-methyl-amine, CTK4E5894, KS-00000UQM, DTXSID00219170, N-(4-bromophenyl)-N-methylamine, AYVPVDWQZAAZCM-UHFFFAOYSA-N, ALBB-021053, ZINC2505869, AKOS000253996, FS-4613, AJ-36085, AK110630, CJ-08472, SC-13359, DB-055227, ST2418210, TC-168997, 4CH-015848, B4403, CS-0038061, FT-0636286, Z5039, M-9581, A836358, Benzenamine,4-bromo-N-methyl-, radical ion(1+) (9CI), I14-101406, C7H8BrN, (4-bromophenyl)methylamine, C7-H8-Br-N, Manganese(II) bis(glycinate), Benzenamine,4-bromo-N-methyl-, CID2757052,

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	12A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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