200,000+ products from a single source!
sales@angenechem.com
Home > Quinoline > 1053655-98-3
1053655-98-3 | 1-(Isoquinolin-8-yl)ethanone
CAS No: 1053655-98-3 Catalog No: AG0096I9 MDL No:MFCD10699238
Product Description
Catalog Number:
AG0096I9
Chemical Name:
1-(Isoquinolin-8-yl)ethanone
CAS Number:
1053655-98-3
Molecular Formula:
C11H9NO
Molecular Weight:
171.1953
MDL Number:
MFCD10699238
IUPAC Name:
1-isoquinolin-8-ylethanone
InChI:
InChI=1S/C11H9NO/c1-8(13)10-4-2-3-9-5-6-12-7-11(9)10/h2-7H,1H3
InChI Key:
FUYYTGDVYCCNEE-UHFFFAOYSA-N
SMILES:
CC(=O)c1cccc2c1cncc2
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.068g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.199g/mol
Monoisotopic Mass:
171.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
© 2019 Angene International Limited. All rights Reserved.