AG007OXG

222978-02-1 | 2-Fluoro-4-(hydroxymethyl)benzonitrile

AG007OXG

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CAS Number	222978-02-1
Catalog Number	AG007OXG(AGN-PC-00H0TW)
Chemical Name	2-Fluoro-4-(hydroxymethyl)benzonitrile
IUPAC Name	2-fluoro-4-(hydroxymethyl)benzonitrile
InChI	InChI=1S/C8H6FNO/c9-8-3-6(5-11)1-2-7(8)4-10/h1-3,11H,5H2
InChI Key	WLQHJQUGYACADR-UHFFFAOYSA-N
MDL Number	MFCD08236861
Molecular Formula	C8H6FNO
Molecular Weight	151.1377
SMILES	N#CC1=CC=C(CO)C=C1F
Synonyms	2-fluoro-4-(hydroxymethyl)benzonitrile, 222978-02-1, 4-Cyano-3-fluorobenzyl alcohol, 2-Fluoro-4-(hydroxymethyl)benzenecarbonitrile, ACMC-209fuo, 3-fluoro-4-cyanobenzyl alcohol, SCHEMBL3164050, 4-cyano-3-fluoro-benzyl alcohol, CTK4E9141, DTXSID10473983, WLQHJQUGYACADR-UHFFFAOYSA-N, KS-00000N1G, 2-Fluoro-4-hydroxymethylbenzonitrile, fluorohydroxymethylbenzenecarbonitrile, ANW-24814, CL8922, MFCD08236861, SBB086758, ZINC12336554, 2-Fluoro-4-hydroxymethyl-benzonitrile, AKOS005072202, AB44199, CS-W005493, DB-0605, MCULE-7493085073, RP10004, RTR-010509, AJ-60967, AK-30948, Benzonitrile,2-fluoro-4-(hydroxymethyl)-, CJ-13770, AB0023523, ST2416884, TR-010509, 4CH-015166, FT-0680920, W4597, B-7982, 2-fluoranyl-4-(hydroxymethyl)benzenecarbonitrile, A816093, BENZONITRILE, 2-FLUORO-4-(HYDROXYMETHYL)-, 2-fluoro-4-(hydroxymethyl)benzonitrile, AldrichCPR, J-509386, I01-15167, C8H6FNO, CID11829631, Benzonitrile, 2-fluoro-4-(hydroxymethyl)- (9CI),

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	1
Isotope Atom Count	0
Molecular Weight	151.14g/mol
Monoisotopic Mass	151.043g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	44A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

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