AG007S9R

186590-34-1 | 3,4-Difluoro-2-hydroxybenzonitrile

AG007S9R

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CAS Number	186590-34-1
Catalog Number	AG007S9R(AGN-PC-04Q09S)
Chemical Name	3,4-Difluoro-2-hydroxybenzonitrile
IUPAC Name	3,4-difluoro-2-hydroxybenzonitrile
InChI	InChI=1S/C7H3F2NO/c8-5-2-1-4(3-10)7(11)6(5)9/h1-2,11H
InChI Key	ZQTPRXJPZPHNAJ-UHFFFAOYSA-N
MDL Number	MFCD03428595
Molecular Formula	C7H3F2NO
Molecular Weight	155.1016
SMILES	N#CC1=CC=C(F)C(F)=C1O
Synonyms	3,4-Difluoro-2-hydroxybenzonitrile, 186590-34-1, 6-Cyano-2,3-difluorophenol, SCHEMBL1128857, CTK8E4285, DTXSID30641066, ZQTPRXJPZPHNAJ-UHFFFAOYSA-N, ZINC2586044, 3,4-difluoro-2-hydroxy-benzonitrile, AKOS006278916, AK441661, RT-008189, FT-0731899, Benzonitrile, 3,4-difluoro-2-hydroxy- (9CI), 862088-17-3,

Complexity	188
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	155.018g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	155.104g/mol
Monoisotopic Mass	155.018g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	44A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H332
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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