Home Nitriles 4,6-dihydroxybenzene-1,3-dicarbonitrile

4,6-dihydroxybenzene-1,3-dicarbonitrile

CAS No.:
75610-34-3
Catalog Number:
AG01DWNF
Molecular Formula:
C8H4N2O2
Molecular Weight:
160.1296
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Product Description
Catalog Number:
AG01DWNF
Chemical Name:
4,6-dihydroxybenzene-1,3-dicarbonitrile
CAS Number:
75610-34-3
Molecular Formula:
C8H4N2O2
Molecular Weight:
160.1296
MDL Number:
MFCD31616421
IUPAC Name:
4,6-dihydroxybenzene-1,3-dicarbonitrile
InChI:
InChI=1S/C8H4N2O2/c9-3-5-1-6(4-10)8(12)2-7(5)11/h1-2,11-12H
InChI Key:
FPRQCDXOTPOQES-UHFFFAOYSA-N
SMILES:
N#Cc1cc(C#N)c(cc1O)O
Properties
Complexity:
233  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.027g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
160.132g/mol
Monoisotopic Mass:
160.027g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
88A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties