200,000+ products from a single source!
sales@angenechem.com
Home > Quinoline > 680223-90-9
680223-90-9 | 3-(Piperidin-4-yl);isoquinolin-1(2H);-one hydrochloride
CAS No: 680223-90-9 Catalog No: AG00610G MDL No:MFCD13152415
Product Description
Catalog Number:
AG00610G
Chemical Name:
3-(Piperidin-4-yl);isoquinolin-1(2H);-one hydrochloride
CAS Number:
680223-90-9
Molecular Formula:
C14H17ClN2O
Molecular Weight:
264.7506
MDL Number:
MFCD13152415
IUPAC Name:
3-piperidin-4-yl-2H-isoquinolin-1-one;hydrochloride
InChI:
InChI=1S/C14H16N2O.ClH/c17-14-12-4-2-1-3-11(12)9-13(16-14)10-5-7-15-8-6-10;/h1-4,9-10,15H,5-8H2,(H,16,17);1H
InChI Key:
BYSNLBSAOFVXIV-UHFFFAOYSA-N
SMILES:
O=c1[nH]c(cc2c1cccc2)C1CCNCC1.Cl
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.103g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
264.753g/mol
Monoisotopic Mass:
264.103g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.