200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 1259062-50-4
1259062-50-4 | 1H-Azepine-4-carbonitrile, hexahydro-
CAS No: 1259062-50-4 Catalog No: AG000OYC MDL No:MFCD23106070
Product Description
Catalog Number:
AG000OYC
Chemical Name:
1H-Azepine-4-carbonitrile, hexahydro-
CAS Number:
1259062-50-4
Molecular Formula:
C7H12N2
Molecular Weight:
124.1836
MDL Number:
MFCD23106070
IUPAC Name:
azepane-4-carbonitrile
InChI:
InChI=1S/C7H12N2/c8-6-7-2-1-4-9-5-3-7/h7,9H,1-5H2
InChI Key:
FDDYAXBCPQKJLJ-UHFFFAOYSA-N
SMILES:
N#CC1CCNCCC1
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.1g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
124.187g/mol
Monoisotopic Mass:
124.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.