AG006ZMK

43111-31-5 | 2-(2-Chlorophenoxy)acetonitrile

AG006ZMK

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CAS Number	43111-31-5
Catalog Number	AG006ZMK(AGN-PC-0JS9VB)
Chemical Name	2-(2-Chlorophenoxy)acetonitrile
IUPAC Name	2-(2-chlorophenoxy)acetonitrile
InChI	InChI=1S/C8H6ClNO/c9-7-3-1-2-4-8(7)11-6-5-10/h1-4H,6H2
InChI Key	JWRJGSQLKHGQOT-UHFFFAOYSA-N
MDL Number	MFCD00017331
Molecular Formula	C8H6ClNO
Molecular Weight	167.5923
SMILES	N#CCOC1=CC=CC=C1Cl
Synonyms	2-(2-Chlorophenoxy)acetonitrile, 43111-31-5, 2-Chlorophenoxyacetonitrile, (2-Chlorophenoxy)-acetonitrile, MFCD00017331, 2-(2-chlorophenoxy)ethanenitrile, ACMC-20anxp, AC1LAV64, (o-Chlorophenoxy)acetonitrile, SCHEMBL4293680, (2-chloro-phenoxy)-acetonitrile, CTK3J3186, DTXSID10334560, JWRJGSQLKHGQOT-UHFFFAOYSA-N, 2-(2-chloranylphenoxy)ethanenitrile, Acetonitrile,2-(2-chlorophenoxy)-, ZINC2146977, 3274AE, SBB088116, AKOS000187688, AC-7261, AN-9210, FS-1692, MCULE-9076983940, CJ-33042, SY005438, AB1000468, DB-016318, RT-001312, FT-0611992, FT-0611993, ST50405921, MFCD00017331 (95%), A826158, J-505583, I14-111589, null, C8H6ClNO, CID521134, ZINC02146977,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	167.014g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	167.592g/mol
Monoisotopic Mass	167.014g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	33A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number