200,000+ products from a single source!
sales@angenechem.com
Home > Quinoline > 144692-04-6
144692-04-6 | Propanedial, 2-(3,4-dihydro-1(2H)-isoquinolinylidene)-
CAS No: 144692-04-6 Catalog No: AG001K0X MDL No:
Product Description
Catalog Number:
AG001K0X
Chemical Name:
Propanedial, 2-(3,4-dihydro-1(2H)-isoquinolinylidene)-
CAS Number:
144692-04-6
Molecular Formula:
C12H11NO2
Molecular Weight:
201.2212
IUPAC Name:
2-(3,4-dihydroisoquinolin-1-yl)-3-hydroxyprop-2-enal
InChI:
InChI=1S/C12H11NO2/c14-7-10(8-15)12-11-4-2-1-3-9(11)5-6-13-12/h1-4,7-8,14H,5-6H2
InChI Key:
UAJSARPDUFJUQS-UHFFFAOYSA-N
SMILES:
O=CC(=C1NCCc2c1cccc2)C=O
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
201.225g/mol
Monoisotopic Mass:
201.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.