AG003HGE

6277-17-4 | 2-Iodo-1-methyl-3-nitrobenzene

AG003HGE

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CAS Number	6277-17-4
Catalog Number	AG003HGE(AGN-PC-0JOBO2)
Chemical Name	2-Iodo-1-methyl-3-nitrobenzene
IUPAC Name	2-iodo-1-methyl-3-nitrobenzene
InChI	InChI=1S/C7H6INO2/c1-5-3-2-4-6(7(5)8)9(10)11/h2-4H,1H3
InChI Key	AKYPSJARSQSCHJ-UHFFFAOYSA-N
MDL Number	MFCD00091040
Molecular Formula	C7H6INO2
Molecular Weight	263.0325
NSC Number	35343
SMILES	O=[N+](C1=C(I)C(C)=CC=C1)[O-]
Synonyms	2-iodo-1-methyl-3-nitrobenzene, 6277-17-4, 2-Iodo-3-nitrotoluene, 2-Iodo-3-methylnitrobenzene, Benzene, 2-iodo-1-methyl-3-nitro-, AKYPSJARSQSCHJ-UHFFFAOYSA-N, 2-Iodo-1-methyl-3-nitro-benzene, NSC35343, 2-iodo-nitrotoluene, iodomethylnitrobenzene, 3-nitro-2-iodo-toluene, AC1Q2FHX, AC1Q4PAQ, AC1L5SY8, 2-Methyl-6-nitroiodobenzene, ACMC-209n86, SCHEMBL2578818, 2-Iodo-3-nitrotoluene, 97%, 2-IODO-3-NITRO TOLUENE, CTK5B5955, DTXSID20284067, KS-00000N3B, ZINC1667550, Benzene,2-iodo-1-methyl-3-nitro-, ANW-34372, CI-255, MFCD00091040, NSC-35343, SBB102619, 2-METHYL-6-NITRO-IODOBENZENE, AKOS005073784, AS02276, MCULE-7937142158, RP14805, SS-2957, AJ-29071, AK115865, TR-037335, CS-0041329, FT-0681258, I0799, TL80090841, EN300-39781, A-8652, J-509703, I01-15489, AR-1E2820, CID234781, 68227-32-7,

Complexity	157
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	262.944g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	263.034g/mol
Monoisotopic Mass	262.944g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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