AG002BCY

198203-94-0 | Benzonitrile, 2-fluoro-3-methoxy-

AG002BCY

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CAS Number	198203-94-0
Catalog Number	AG002BCY(AGN-PC-0N93O5)
Chemical Name	Benzonitrile, 2-fluoro-3-methoxy-
IUPAC Name	2-fluoro-3-methoxybenzonitrile
InChI	InChI=1S/C8H6FNO/c1-11-7-4-2-3-6(5-10)8(7)9/h2-4H,1H3
InChI Key	MTZXEJOKWAFGGH-UHFFFAOYSA-N
MDL Number	MFCD09839223
Molecular Formula	C8H6FNO
Molecular Weight	151.1377
SMILES	N#CC1=CC=CC(OC)=C1F
Synonyms	2-fluoro-3-methoxybenzonitrile, 198203-94-0, Benzonitrile, 2-fluoro-3-methoxy-, 2-fluoro-3-methoxy-benzonitrile, BENZONITRILE, 2-FLUORO-3-METHOXY- (9CI), 2-Fluoro-3-methoxy benzonitrile, PubChem4782, ACMC-209f2r, SCHEMBL2655872, CTK4E2443, KS-00000EJE, DTXSID00443635, MTZXEJOKWAFGGH-UHFFFAOYSA-N, ACT00544, ANW-23809, MFCD09839223, TD1214, ZINC21304519, AKOS006328782, AM82833, AS05852, CM13079, LS10265, RP21446, RTR-009201, AC-28501, AJ-78542, AK-33951, BR-33951, CJ-16951, CS-11561, SC-52940, SY025111, 2-Fluoro-3-methoxybenzonitrile, AldrichCPR, AB0023194, TR-009201, 4CH-000297, FT-0691675, ST24027995, TL80074080, W4203, MFCD09839223 (97%), A21178, B-7687, J-509373, C8H6FNO, ACN-052112, CID10701985,

Complexity	174
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	151.043g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	151.14g/mol
Monoisotopic Mass	151.043g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	33A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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