AG003HBO

326-62-5 | 2-(2-Fluorophenyl)acetonitrile

AG003HBO

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CAS Number	326-62-5
Catalog Number	AG003HBO(AGN-PC-0JL7WJ)
Chemical Name	2-(2-Fluorophenyl)acetonitrile
EC Number	206-313-0
IUPAC Name	2-(2-fluorophenyl)acetonitrile
InChI	InChI=1S/C8H6FN/c9-8-4-2-1-3-7(8)5-6-10/h1-4H,5H2
InChI Key	DAVJMKMVLKOQQC-UHFFFAOYSA-N
MDL Number	MFCD00002197
Molecular Formula	C8H6FN
Molecular Weight	135.1383
NSC Number	88280
SMILES	N#CCC1=CC=CC=C1F
Synonyms	326-62-5, 2-Fluorophenylacetonitrile, 2-(2-fluorophenyl)acetonitrile, 2-Fluorobenzyl cyanide, Benzeneacetonitrile, 2-fluoro-, o-Fluorophenylacetonitrile, o-Fluorobenzyl cyanide, (2-fluorophenyl)acetonitrile, Acetonitrile, (o-fluorophenyl)-, MFCD00001897, 2-(2-fluorophenyl)ethanenitrile, 2-FLUOROBENZENEACETONITRILE, DAVJMKMVLKOQQC-UHFFFAOYSA-N, EINECS 206-313-0, NSC 88280, PubChem2611, ACMC-209hug, AC1Q4L4I, NCIOpen2_001403, KSC497S0J, (2-fluorophenyl)-acetonitrile, SCHEMBL103401, (2-fluoro-phenyl)-acetonitrile, AC1L27W2, DTXSID1059810, CTK3J7904, 2-Fluorophenylacetonitrile, 97%, OTAVA-BB 1519443, ZINC406998, ACT12854, NSC88280, ANW-27398, NSC-88280, SBB063693, STL169028, AKOS000199190, AB00172, AM61480, AS01388, CS-W013356, MCULE-3523224054, PF10720, PS-9130, RTR-033580, TRA0079180, AC-26164, AJ-22551, AK-48152, AN-44298, BR-48152, CJ-04109, SC-03478, ZB013734, DB-023895, ST2416042, TR-033580, F0257, FT-0612448, ST51016235, A22012, M-7240, I01-2601, J-018827, Z1262252900, InChI=1/C8H6FN/c9-8-4-2-1-3-7(8)5-6-10/h1-4H,5H, 2-Fluorobenzyl cyanide;Acetonitrile, (o-fluorophenyl)-;o-Fluorobenzyl cyanide, 2-Fluorobenzylcyanide, C8H6FN, C8-H6-F-N, CID67592, 2-Fluorophenylacetonitrile, 97% - 10G 10g,

Complexity	147
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	135.048g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	135.141g/mol
Monoisotopic Mass	135.048g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	23.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H302+H312+H332-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P305+P351+P338
UN Code	UN 1993

Certificate of Analysis

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