AG00FABJ

7149-70-4 | 2-Bromo-5-nitrotoluene

AG00FABJ

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CAS Number	7149-70-4
Catalog Number	AG00FABJ(AGN-PC-0JNQF7)
Chemical Name	2-Bromo-5-nitrotoluene
EC Number	230-481-4
IUPAC Name	1-bromo-2-methyl-4-nitrobenzene
InChI	InChI=1S/C7H6BrNO2/c1-5-4-6(9(10)11)2-3-7(5)8/h2-4H,1H3
InChI Key	HIMGPQVBNICCGL-UHFFFAOYSA-N
MDL Number	MFCD00007281
Molecular Formula	C7H6BrNO2
Molecular Weight	216.0320
NSC Number	72323
SMILES	O=[N+](C1=CC=C(Br)C(C)=C1)[O-]
Synonyms	2-Bromo-5-nitrotoluene, 7149-70-4, 1-Bromo-2-methyl-4-nitrobenzene, 4-Bromo-3-methylnitrobenzene, MFCD00007281, Benzene, 1-bromo-2-methyl-4-nitro-, bromo(5-)-2-nitrotoluene, HIMGPQVBNICCGL-UHFFFAOYSA-N, NSC72323, 2Bromo-5-nitrotoluene, PubChem12553, ACMC-209oiv, AC1L5KD2, AC1Q25ZR, AC1Q2D3O, SCHEMBL85170, Toluene, 2-bromo-5-nitro-, KSC498A8D, methyl 2-bromo-5-nitrobenzene, SCHEMBL8337770, 2-Bromo-5-nitrotoluene, 98%, CTK3J8081, HIMGPQVBNICCGL-UHFFFAOYSA-, KS-00000ENM, TIMTEC-BB SBB006703, BROMO(5)-2-NITROTOLUENE, ATTERCOP-CHM AT114461, 1-bromo-2-methyl-4-nitro benzene, 1-bromo-2-methyl-4-nitro-benzene, ACT07741, STR06684, ZINC1698450, 1-Bromo-2-methyl-4-nitrobenzene #, 2-BROMO-5-NITROMETHYLBENZENE, 2-METHYL-4-NITROBROMOBENZENE, ANW-36053, NSC-72323, SBB006703, STL497621, AKOS005145631, AS03682, CS-W014876, RP26945, RTR-032858, VZ24036, AJ-30361, AK-54902, BC003674, BR-54902, CJ-28522, SC-45942, SY017733, U120, AB0019107, DB-024226, ST2403363, TR-032858, FT-0611502, ST50405300, MFCD00007281 (98%), A-3106, AN-584/43447528, I01-3930, J-508416, InChI=1/C7H6BrNO2/c1-5-4-6(9(10)11)2-3-7(5)8/h2-4H,1H3, C7H6BrNO2, C7-H6-Br-N-O2, EINECS 230-481-4, AR-1G1228, CID251672, RW1820, ACN-056067, B1853, 2-Bromo-5-nitrotoluene, 98% - 25G 25g, 92061-12-6,

Complexity	157
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	214.958g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	216.034g/mol
Monoisotopic Mass	214.958g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number