200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 75941-33-2
75941-33-2 | 1,2-Benzenedicarbonitrile, 3-(hexyloxy)-6-hydroxy-
CAS No: 75941-33-2 Catalog No: AG005H2K MDL No:
Product Description
Catalog Number:
AG005H2K
Chemical Name:
1,2-Benzenedicarbonitrile, 3-(hexyloxy)-6-hydroxy-
CAS Number:
75941-33-2
Molecular Formula:
C14H16N2O2
Molecular Weight:
244.2890
IUPAC Name:
3-hexoxy-6-hydroxybenzene-1,2-dicarbonitrile
InChI:
InChI=1S/C14H16N2O2/c1-2-3-4-5-8-18-14-7-6-13(17)11(9-15)12(14)10-16/h6-7,17H,2-5,8H2,1H3
InChI Key:
GTQZUSKKYDNKNK-UHFFFAOYSA-N
SMILES:
CCCCCCOc1ccc(c(c1C#N)C#N)O
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.121g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.294g/mol
Monoisotopic Mass:
244.121g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
77A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.