AG001ENN

14714-50-2 | Benzeneacetonitrile, 2-hydroxy-

AG001ENN

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CAS Number	14714-50-2
Catalog Number	AG001ENN(AGN-PC-0N7015)
Chemical Name	Benzeneacetonitrile, 2-hydroxy-
IUPAC Name	2-(2-hydroxyphenyl)acetonitrile
InChI	InChI=1S/C8H7NO/c9-6-5-7-3-1-2-4-8(7)10/h1-4,10H,5H2
InChI Key	WMWRBGOAZXDIDN-UHFFFAOYSA-N
MDL Number	MFCD00128130
Molecular Formula	C8H7NO
Molecular Weight	133.1473
SMILES	OC1=C(C=CC=C1)CC#N
Synonyms	(2-hydroxyphenyl)acetonitrile, 14714-50-2, 2-(2-hydroxyphenyl)acetonitrile, Benzeneacetonitrile, 2-hydroxy-, 2-Hydroxyphenylacetonitrile, 2-Hydroxybenzeneacetonitrile, 2-hydroxy-benzeneacetonitrile, ACMC-209cy8, SCHEMBL891289, (2-Hydro xyphenyl)acetonitrile, DTXSID90441963, 2-(2-hydroxyphenyl)-acetonitrile, WMWRBGOAZXDIDN-UHFFFAOYSA-N, 7309AA, ANW-21054, MFCD00128130, ZINC14502872, AKOS016009048, FCH1118807, TRA0085580, AJ-64913, AK-78483, AS-32390, CJ-14552, SY012295, AB0061616, AX8222731, TC-109799, B-7284, MFCD00128130 (97+%), J-509666, C8H7NO, CID10582824,

Complexity	147
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	133.053g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	133.15g/mol
Monoisotopic Mass	133.053g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	44A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

Lot Number