AG002EGH

190271-88-6 | 3-Pyridinecarboxylic acid, 2-chloro-5-nitro-, methyl ester

AG002EGH

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CAS Number	190271-88-6
Catalog Number	AG002EGH(AGN-PC-0229FQ)
Chemical Name	3-Pyridinecarboxylic acid, 2-chloro-5-nitro-, methyl ester
IUPAC Name	methyl 2-chloro-5-nitropyridine-3-carboxylate
InChI	InChI=1S/C7H5ClN2O4/c1-14-7(11)5-2-4(10(12)13)3-9-6(5)8/h2-3H,1H3
InChI Key	IPSMDDVNXJKYRH-UHFFFAOYSA-N
MDL Number	MFCD07368888
Molecular Formula	C7H5ClN2O4
Molecular Weight	216.5786
SMILES	O=C(OC)C1=C(Cl)N=CC([N+]([O-])=O)=C1
Synonyms	Methyl 2-chloro-5-nitronicotinate, 190271-88-6, 2-CHLORO-5-NITRONICOTINIC ACID METHYL ESTER, methyl 2-chloro-5-nitropyridine-3-carboxylate, 2-Chloro-5-nitro-nicotinic acid methyl ester, 2-Chloro-5-NitronicotinicAcidMethylEster, 2-Chloro-5-nitro-nicotinic acid methyle, 3-Pyridinecarboxylic acid, 2-chloro-5-nitro-, methyl ester, MFCD07368888, PubChem14556, methylchloronitronicotinate, SCHEMBL2692671, CTK4E0346, Methyl2-chloro-5-nitronicotinate, DTXSID10596505, IPSMDDVNXJKYRH-UHFFFAOYSA-N, ZINC8698231, ANW-74717, SBB095317, AKOS015849896, AB32147, EE-0704, RP12535, RTR-008824, KS-00001Q27, methyl 2-chloro-5-nitronicotinate 95+%, AC-26929, AJ-58014, AK-33880, SC-20170, AB0076738, AB1005135, DB-025138, TR-008824, 4CH-021945, A4197, CS-0042085, FT-0650035, ST24047702, 2-Chloro-3-(methoxycarbonyl)-5-nitropyridine, A-2226, I02-2122, J-521990, 3-Pyridinecarboxylicacid, 2-chloro-5-nitro-, methyl ester, methyl 2-chloro-5-nitropyridine-3-carboxylate, 2-chloro-3-(methoxycarbonyl)-5-nitropyridine, null,

Complexity	242
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	215.994g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	216.577g/mol
Monoisotopic Mass	215.994g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	85A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

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

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