AG003KX5

77811-44-0 | 4-Bromo-2-methyl-6-nitroaniline

AG003KX5

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CAS Number	77811-44-0
Catalog Number	AG003KX5(AGN-PC-0JSAQX)
Chemical Name	4-Bromo-2-methyl-6-nitroaniline
EC Number	616-508-6
IUPAC Name	4-bromo-2-methyl-6-nitroaniline
InChI	InChI=1S/C7H7BrN2O2/c1-4-2-5(8)3-6(7(4)9)10(11)12/h2-3H,9H2,1H3
InChI Key	ZXFVKFUXKFPUQJ-UHFFFAOYSA-N
MDL Number	MFCD00052919
Molecular Formula	C7H7BrN2O2
Molecular Weight	231.0467
SMILES	CC1=C(N)C(=CC(Br)=C1)[N+]([O-])=O
Synonyms	4-Bromo-2-methyl-6-nitroaniline, 77811-44-0, 4-Bromo-2-methyl-6-nitro-phenylamine, 4-bromo-2-methyl-6-nitrobenzenamine, 4-bromo-6-nitro-o-toluidine, 2-Amino-5-bromo-3-nitrotoluene, MFCD00052919, Benzenamine, 4-bromo-2-methyl-6-nitro-, 2-Nitro-4-bromo-6-methylaniline, ZXFVKFUXKFPUQJ-UHFFFAOYSA-N, 4-bromo-2-methyl-6-nitro-aniline, 4-bromo-2-methyl-6-nitrophenylamine, PubChem3813, AC1LAX8U, AC1Q2FIO, AC1Q2HJV, ACMC-1BG8U, KSC496E7T, 4-Bromo-6-nitro-o-toulidine, SCHEMBL153660, BEN262, CTK3J6279, 4-bromo-6-methyl-2-nitroaniline, DTXSID50335036, ACT11540, BCP08514, CS-M1979, KS-000009WO, ZINC3884500, 4-bromo-6-methyl-2-nitrophenylamine, ANW-74770, CB-627, GEO-00501, KM1876, SBB064130, STL497394, 2-Amino-5-bromo-3-methylnitrobenzene, AKOS005071333, AC-3719, AM62103, AS00330, CM11320, MCULE-4281612705, RP13280, RTR-037798, SB11755, TRA0002696, VZ28478, Benzenamine, 4-bromo-2-methyl-6-nitro, 2-METHYL-4-BROMO-6-NITROANILINE, 4-BROMO-2-METHYL-6-NITROANILIN, 4-Bromo-2-methyl-6-nitroaniline, 97%, BenzenaMine,4-broMo-2-Methyl-6-nitro-, AJ-47115, AK-29532, AN-12705, BC002615, BP-10231, CJ-11148, SC-06766, SY018595, AB0018031, DB-014436, TL8005335, TR-037798, A9827, B3730, FT-0617786, ST24043403, ST50307884, EN300-41031, M04061, MFCD00052919 (97+%), 811B440, 9T-0039, J-508478, W-200503, Z425449814, C7H7BrN2O2, 2-bromo-6-methyl-4-nitroaniline, CID522679, ZINC03884500, ACN-027203, R174, D1264, 4-Bromo-2-methyl-6-nitroaniline, 98% - 1G 1g,

Complexity	183
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	229.969g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	231.049g/mol
Monoisotopic Mass	229.969g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	71.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H312+H332-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number