AG008T5G

121086-19-9 | (4-bromophenyl)isopropylamine

AG008T5G

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CAS Number	121086-19-9
Catalog Number	AG008T5G(AGN-PC-0N5A4L)
Chemical Name	(4-bromophenyl)isopropylamine
IUPAC Name	4-bromo-N-propan-2-ylaniline
InChI	InChI=1S/C9H12BrN/c1-7(2)11-9-5-3-8(10)4-6-9/h3-7,11H,1-2H3
InChI Key	GCAYZUSDLCJJAW-UHFFFAOYSA-N
MDL Number	MFCD08691756
Molecular Formula	C9H12BrN
Molecular Weight	214.1023
SMILES	CC(NC1=CC=C(Br)C=C1)C
Synonyms	4-BROMO-N-ISOPROPYLANILINE, 121086-19-9, Benzenamine,4-bromo-N-(1-methylethyl)-, 4-bromo-N-propan-2-ylaniline, ACMC-209a95, SCHEMBL1455728, CTK4B2173, DTXSID70440752, GCAYZUSDLCJJAW-UHFFFAOYSA-N, CHEMBRDG-BB 5940253, 1-bromo-4-(isopropylamino)-benzene, ANW-17559, MFCD08691756, ZINC19093848, AKOS000240652, CB-3351, RTR-003461, AJ-72243, CJ-15974, Benzenamine, 4-bromo-N-(1-methylethyl)-, ST2405670, TR-003461, Z8271, A-5418, 086B199, I02-2870, C9H12BrN, 4-bromo-N-propan-2-yl-aniline, CID10488798,

Complexity	106
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	213.015g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	214.106g/mol
Monoisotopic Mass	213.015g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	12A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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