AG003RVD

475561-89-8 | Methyl 4-Fluoropyrrole-2-carboxylate

AG003RVD

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CAS Number	475561-89-8
Catalog Number	AG003RVD(AGN-PC-07AEC4)
Chemical Name	Methyl 4-Fluoropyrrole-2-carboxylate
IUPAC Name	methyl 4-fluoro-1H-pyrrole-2-carboxylate
InChI	InChI=1S/C6H6FNO2/c1-10-6(9)5-2-4(7)3-8-5/h2-3,8H,1H3
InChI Key	DQCVQMRMLSMVDL-UHFFFAOYSA-N
MDL Number	MFCD11042594
Molecular Formula	C6H6FNO2
Molecular Weight	143.1157
SMILES	FC=1C=C(NC1)C(=O)OC
Synonyms	Methyl 4-fluoro-1H-pyrrole-2-carboxylate, 475561-89-8, Methyl 4-Fluoropyrrole-2-carboxylate, C6H6FNO2, 4-Fluoro-1H-pyrrole-2-carboxylic Acid Methyl Ester, 2-carbomethoxy-4-fluoropyrrole, SCHEMBL1298467, CTK8C2520, DTXSID90666558, DQCVQMRMLSMVDL-UHFFFAOYSA-N, ANW-68532, MFCD11042594, ZINC45800820, AKOS006309433, SB13772, TRA0019809, AS-38704, DA-17464, SY016341, AJ-110541, TC-157277, CS-0061832, FT-0698452, MFCD11042594 (95+%), 1H-Pyrrole-2-carboxylic acid, 4-fluoro-, methyl ester,

Complexity	140
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	143.038g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	143.117g/mol
Monoisotopic Mass	143.038g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	42.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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