AG003RV9

329-59-9 | Methyl 4-fluoro-3-nitrobenzoate

AG003RV9

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CAS Number	329-59-9
Catalog Number	AG003RV9(AGN-PC-0LOOF0)
Chemical Name	Methyl 4-fluoro-3-nitrobenzoate
IUPAC Name	methyl 4-fluoro-3-nitrobenzoate
InChI	InChI=1S/C8H6FNO4/c1-14-8(11)5-2-3-6(9)7(4-5)10(12)13/h2-4H,1H3
InChI Key	CNJJSTPBUHAEFH-UHFFFAOYSA-N
MDL Number	MFCD00196161
Molecular Formula	C8H6FNO4
Molecular Weight	199.1359
SMILES	FC1=C(C=C(C(=O)OC)C=C1)[N+](=O)[O-]
Synonyms	Methyl 4-fluoro-3-nitrobenzoate, 329-59-9, Methyl 4-fluoro-3-nitro-benzoate, 4-fluoro-3-nitrobenzoic acid methyl ester, MFCD00196161, 4-fluoro-3-nitro-benzoic acid methyl ester, Benzoic acid, 4-fluoro-3-nitro-, methyl ester, 329-59-9 Methyl 4-fluoro-3-nitrobenzoate, PubChem2045, ACMC-209hxf, AC1NQE0I, SCHEMBL31493, AC1Q42W8, AMBZ0427, Jsp006066, methyl 4-fluoro-3 nitrobenzoate, CTK3J5384, KS-00000BBP, DTXSID00410923, CNJJSTPBUHAEFH-UHFFFAOYSA-N, WT425, 4-carbomethoxy-2-nitrofluorobenzene, ACT00900, ZINC3124826, ANW-27505, SBB092417, STL194103, WT2182, AKOS000779333, METHYL4-FLUORO-3-NITROBENZOATE, CS-W004731, GS-3329, MCULE-4681823535, QC-8214, RP25677, RTX-012043, TRA0051302, VZ32651, Methyl 4-fluoro-3-nitrobenzoate, 97%, 2-Fluoro-5-(methoxycarbonyl)nitrobenzene, AJ-44527, AK-34719, AM803705, AN-44334, BP-11729, BR-34719, CJ-10582, Q185, SC-47927, SY002058, TL806161, 3-Nitro-4-fluorobenzoic acid methyl ester, 3-Nitro-4-fluoro-benzoic acid methyl ester, AB0004365, DB-007683, ST2419584, 4CH-014087, FT-0082348, FT-0600643, M2535, ST50336370, VU0612247-1, M-7475, MFCD00196161 (97+%), 329M599, 4-Fluoro-3-nitrobenzenecarboxylic acid, methyl ester, J-522345, F3358-0070, C8H6FNO4, ACN-056564, CID5219721,

Complexity	240
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	199.028g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	199.137g/mol
Monoisotopic Mass	199.028g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	72.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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