AG003GOX

7745-93-9 | 2-Bromo-4-nitrotoluene

AG003GOX

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CAS Number	7745-93-9
Catalog Number	AG003GOX(AGN-PC-0JLTQB)
Chemical Name	2-Bromo-4-nitrotoluene
EC Number	231-809-9
IUPAC Name	2-bromo-1-methyl-4-nitrobenzene
InChI	InChI=1S/C7H6BrNO2/c1-5-2-3-6(9(10)11)4-7(5)8/h2-4H,1H3
InChI Key	XFZFJQHXWJIBQV-UHFFFAOYSA-N
MDL Number	MFCD00007195
Molecular Formula	C7H6BrNO2
Molecular Weight	216.0320
NSC Number	402166
SMILES	O=N(=O)c1ccc(c(c1)Br)C
Synonyms	2-Bromo-4-nitrotoluene, 7745-93-9, 2-Bromo-1-methyl-4-nitrobenzene, Benzene, 2-bromo-1-methyl-4-nitro-, 3-Bromo-4-methylnitrobenzene, Toluene, 2-bromo-4-nitro-, 1-Bromo-2-methyl-5-nitrobenzene, MFCD00007195, 3-bromo-4-methyl nitrobenzene, XFZFJQHXWJIBQV-UHFFFAOYSA-N, 2-bromo-1-methyl-4-nitro-benzene, EINECS 231-809-9, NSC402166, PubChem3822, 2-Bromo-4nitrotoluene, 2-Bromo4-nitrotoluene, AC1Q2LRU, 2-bromo-4-nitro-toluene, 4-nitro-2-bromo toluene, ACMC-209pa3, AC1L32WY, AC1Q25KP, AC1Q2D3C, KSC494E2T, ARONIS24144, SCHEMBL113519, PARAGOS 440098, 2-Bromo-4-nitrotoluene, 98%, CTK3J4229, TIMTEC-BB SBB007843, XFZFJQHXWJIBQV-UHFFFAOYSA-, 3-bromo-4-methyl-1-nitrobenzene, DTXSID20228163, ATTERCOP-CHM AT114427, OTAVA-BB 1362064, ACT13418, BCP26582, KS-000001SF, ZINC1081254, 2-Bromo-1-methyl-4-nitrobenzene #, 2-METHYL-5-NITROBROMOBENZENE, ANW-37033, BBL023654, BR1352, RW3084, SBB007843, STL069545, AKOS000121030, AN-1573, AS03442, CM13935, CS-W009519, FR-0441, LS10327, MCULE-3242184016, NSC-402166, QC-2528, RP26946, RTR-024747, TRA0055464, KS-000046K6, AC-25924, AJ-24927, AK-36359, AS-14220, BC002621, BR-36359, CJ-04735, K352, SC-06752, SY007277, ZB015907, AB0007449, AB1005619, DB-024244, ST2409679, TR-024747, A9802, B1262, FT-0611469, FT-0652934, ST45053311, TL80073548, MFCD00007195 (98%), C-4582, AE-641/04636041, I01-6217, W-104315, InChI=1/C7H6BrNO2/c1-5-2-3-6(9(10)11)4-7(5)8/h2-4H,1H3, null, C7H6BrNO2, C7-H6-Br-N-O2, CID82189, AR-1D9518, ACN-052791, 2-Bromo-4-nitrotoluene, 98% - 25G 25g, 82043-11-6,

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	3.2

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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