AG00C1WX

214279-40-0 | 3-Iodo-4-Nitroanisole

AG00C1WX

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CAS Number	214279-40-0
Catalog Number	AG00C1WX(AGN-PC-0KK62D)
Chemical Name	3-Iodo-4-Nitroanisole
IUPAC Name	2-iodo-4-methoxy-1-nitrobenzene
InChI	InChI=1S/C7H6INO3/c1-12-5-2-3-7(9(10)11)6(8)4-5/h2-4H,1H3
InChI Key	NLTAHTYBZZSCIT-UHFFFAOYSA-N
MDL Number	MFCD01320682
Molecular Formula	C7H6INO3
Molecular Weight	279.0319
SMILES	O=[N+](C1=CC=C(OC)C=C1I)[O-]
Synonyms	3-Iodo-4-nitroanisole, 2-iodo-4-methoxy-1-nitrobenzene, 214279-40-0, 4-Nitro-3-iodoanisole, Benzene, 2-iodo-4-methoxy-1-nitro-, 3-Iodo-4-nitroanisole, 97%, AC1MBYY4, SCHEMBL1025833, CTK7A0786, KS-00000ZQP, DTXSID70369919, 1-Nitro-2-iodo-4-methoxybenzene, NLTAHTYBZZSCIT-UHFFFAOYSA-N, 3-iodo-4-nitrophenyl methyl ether, ZINC2379303, Benzene,2-iodo-4-methoxy-1-nitro-, MFCD01320682, AKOS015890567, AS05501, CM11785, NE33918, RP29800, VZ26977, AJ-34562, AK121788, AS-33041, DB-012091, 4CH-004610, FT-0600699, Z2572, 2-Iodo-4-methoxy-1-nitrobenzene, AldrichCPR, A20634, I01-7587, J-509708, C7H6INO3, CI-463, ZINC02379303, CID2733456, D1309,

Complexity	171
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	278.939g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	279.033g/mol
Monoisotopic Mass	278.939g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	55A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number