CAS 30757-50-7 | 1,2-Benzenedicarbonitrile, 4-hydroxy- | CAS Number 30757-50-7

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30757-50-7 | 1,2-Benzenedicarbonitrile, 4-hydroxy-

CAS No: 30757-50-7 Catalog No: AG00317E MDL No:MFCD00191653

Product Description

Catalog Number:

AG00317E

Chemical Name:

1,2-Benzenedicarbonitrile, 4-hydroxy-

CAS Number:

30757-50-7

Molecular Formula:

C8H4N2O

Molecular Weight:

144.1302

MDL Number:

MFCD00191653

IUPAC Name:

4-hydroxybenzene-1,2-dicarbonitrile

InChI:

InChI=1S/C8H4N2O/c9-4-6-1-2-8(11)3-7(6)5-10/h1-3,11H

InChI Key:

FTVOPKROFUTOKY-UHFFFAOYSA-N

SMILES:

N#Cc1cc(O)ccc1C#N

Properties

Complexity:

231

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

144.032g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

144.133g/mol

Monoisotopic Mass:

144.032g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
Protolytic dissociation of cyanophenols in ground and excited states in alcohol and water solutions.	Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20110801
Synthesis, characterization, and photovoltaic properties of soluble TiOPc derivatives.	International journal of molecular sciences 20081201