AG00357J

14719-83-6 | Methyl 4-chloro-3-nitrobenzate

AG00357J

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CAS Number	14719-83-6
Catalog Number	AG00357J(AGN-PC-0JVO22)
Chemical Name	Methyl 4-chloro-3-nitrobenzate
IUPAC Name	methyl 4-chloro-3-nitrobenzoate
InChI	InChI=1S/C8H6ClNO4/c1-14-8(11)5-2-3-6(9)7(4-5)10(12)13/h2-4H,1H3
InChI Key	XRTKWPWDSUNLHS-UHFFFAOYSA-N
MDL Number	MFCD00016989
Molecular Formula	C8H6ClNO4
Molecular Weight	215.5905
SMILES	ClC1=C(C=C(C(=O)OC)C=C1)[N+](=O)[O-]
Synonyms	Methyl 4-chloro-3-nitrobenzoate, 14719-83-6, Methyl 4-chloro-3-nitrobenzate, 4-Chloro-3-nitrobenzoic Acid Methyl Ester, Methyl-4-chloro-3-nitrobenzoate, Benzoic acid, 4-chloro-3-nitro-, methyl ester, MFCD00016989, AC1LEGOH, ACMC-209cya, SCHEMBL51755, ARONIS001848, methyl-3-nitro-4-chlorobenzoate, CTK4C5294, KS-00000IWE, Methyl 3-nitro-4-chlorobenzoate, XRTKWPWDSUNLHS-UHFFFAOYSA-, DTXSID40352833, methyl 4-chloro-3-nitro-benzoate, XRTKWPWDSUNLHS-UHFFFAOYSA-N, ZINC152974, ALBB-019975, KS-00003V7V, ANW-21056, BBL009126, SBB063178, STK409484, AKOS000265829, METHYL4-CHLORO-3-NITROBENZOATE, CM-1479, CS-W014886, MCULE-8875385814, PS-6192, TRA0062212, VZ32645, 2-Chloro-5-(methoxycarbonyl)nitrobenzene, AC-13716, AJ-12866, AK-41424, BP-21348, BR-41424, CJ-01212, SY019035, TL806275, ZB005309, 3-Nitro-4-chlorobenzoic acid methyl ester, 4-Chloro-3-nitro-benzoic acid methyl ester, AB0008407, DB-012876, TC-061445, FT-0628626, M1779, ST24033251, ST45026627, Benzoic acid,4-chloro-3-nitro-, methyl ester, 1D-154, B-2216, MFCD00016989 (97+%), 719M836, I01-0713, J-008324, F3145-1469, InChI=1/C8H6ClNO4/c1-14-8(11)5-2-3-6(9)7(4-5)10(12)13/h2-4H,1H3, C8H6ClNO4, CID735797, ZINC00152974, Methyl 4-chloro-3-nitrobenzoate, 97.5% - 25G 25g,

Complexity	240
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	214.999g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	215.589g/mol
Monoisotopic Mass	214.999g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	72.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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