AG00BZCF

367-80-6 | Ethyl 4-fluoro-3-nitrobenzoate

AG00BZCF

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CAS Number	367-80-6
Catalog Number	AG00BZCF(AGN-PC-037YBF)
Chemical Name	Ethyl 4-fluoro-3-nitrobenzoate
EC Number	609-290-9
IUPAC Name	ethyl 4-fluoro-3-nitrobenzoate
InChI	InChI=1S/C9H8FNO4/c1-2-15-9(12)6-3-4-7(10)8(5-6)11(13)14/h3-5H,2H2,1H3
InChI Key	YONVBKVUSUGBQR-UHFFFAOYSA-N
MDL Number	MFCD03428515
Molecular Formula	C9H8FNO4
Molecular Weight	213.1625
SMILES	N(=O)(=O)c1cc(C(=O)OCC)ccc1F
Synonyms	Ethyl 4-fluoro-3-nitrobenzoate, 367-80-6, 4-Fluoro-3-nitrobenzoic acid ethyl ester, Benzoic acid, 4-fluoro-3-nitro-, ethyl ester, AK-34875, Ethyl4-Fluoro-3-nitrobenzoate, ACMC-209ion, KSC221S8R, ethyl 4-flouro-3-nitrobenzoate, ethyl-4-fluoro-3-nitrobenzoate, SCHEMBL1305326, Ethyl 3-nitro-4-Fluorobenzoate, Jsp006537, RARECHEM AL BI 0858, CTK1C1988, ethyl 3-nitro-4-fluoro-benzoate, ethyl 4-fluoro-3-nitro-benzoate, KS-00000FQT, DTXSID20611894, YONVBKVUSUGBQR-UHFFFAOYSA-N, AM944, ACT00985, ZINC2585983, ZX-AP007353, ANW-28485, CE-063, MFCD03428515, PC1485, SBB063047, STL419592, AKOS009165658, AKOS015888123, AS01880, GS-3058, RTC-062709, VZ32142, 5-(Ethoxycarbonyl)-2-fluoronitrobenzene, 3-Nitro-4-fluorobenzoic acid ethyl ester, AJ-43662, AN-14600, BBV-22159438, BC210592, BR-34875, CC-28005, CJ-10406, M402, SC-17791, SY024320, 4-fluoro-3-nitro-benzoic acid ethyl ester, AB0015192, AX8011630, DB-049000, TC-062709, TL8002717, CS-0012717, FT-0602442, ST24033199, MFCD03428515 (98%), A20026, EN300-155079, C-11220, I01-0195, C9H8FNO4, AC-1802, M-2060,

Complexity	253
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	213.044g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	213.164g/mol
Monoisotopic Mass	213.044g/mol
Rotatable Bond Count	3
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	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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