200,000+ products from a single source!
sales@angenechem.com
88347-13-1 | 8-Quinolinecarbonitrile, 3-chloro-7-(propylamino)-
CAS No: 88347-13-1 Catalog No: AG0046F2 MDL No:
Product Description
Catalog Number:
AG0046F2
Chemical Name:
8-Quinolinecarbonitrile, 3-chloro-7-(propylamino)-
CAS Number:
88347-13-1
Molecular Formula:
C13H12ClN3
Molecular Weight:
245.7075
IUPAC Name:
3-chloro-7-(propylamino)quinoline-8-carbonitrile
InChI:
InChI=1S/C13H12ClN3/c1-2-5-16-12-4-3-9-6-10(14)8-17-13(9)11(12)7-15/h3-4,6,8,16H,2,5H2,1H3
InChI Key:
LZHIUNGXMIZSMZ-UHFFFAOYSA-N
SMILES:
CCCNc1ccc2c(c1C#N)ncc(c2)Cl
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.072g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.71g/mol
Monoisotopic Mass:
245.072g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.