200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 100-45-8
100-45-8 | Cyclohex-3-enecarbonitrile
CAS No: 100-45-8 Catalog No: AG00006A MDL No:MFCD00013778
Product Description
Catalog Number:
AG00006A
Chemical Name:
Cyclohex-3-enecarbonitrile
CAS Number:
100-45-8
Molecular Formula:
C7H9N
Molecular Weight:
107.1531
MDL Number:
MFCD00013778
IUPAC Name:
cyclohex-3-ene-1-carbonitrile
InChI:
InChI=1S/C7H9N/c8-6-7-4-2-1-3-5-7/h1-2,7H,3-5H2
InChI Key:
GYBNBQFUPDFFQX-UHFFFAOYSA-N
SMILES:
N#CC1CCC=CC1
NSC Number:
7407
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
107.073g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
107.156g/mol
Monoisotopic Mass:
107.073g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.