200,000+ products from a single source!
sales@angenechem.com
Home > Quinoline > 1293990-82-5
1293990-82-5 | 4-(HYDROXYMETHYL)-1,2,3,4-TETRAHYDROISOQUINOLIN-1-ONE
CAS No: 1293990-82-5 Catalog No: AG01BPQN MDL No:MFCD24617809
Product Description
Catalog Number:
AG01BPQN
Chemical Name:
4-(HYDROXYMETHYL)-1,2,3,4-TETRAHYDROISOQUINOLIN-1-ONE
CAS Number:
1293990-82-5
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
MDL Number:
MFCD24617809
IUPAC Name:
4-(hydroxymethyl)-3,4-dihydro-2H-isoquinolin-1-one
InChI:
InChI=1S/C10H11NO2/c12-6-7-5-11-10(13)9-4-2-1-3-8(7)9/h1-4,7,12H,5-6H2,(H,11,13)
InChI Key:
LNJOLFDIACSLIT-UHFFFAOYSA-N
SMILES:
OCC1CNC(=O)c2c1cccc2
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.