200,000+ products from a single source!
sales@angenechem.com
98661-43-9 | 2-(6,7-DIETHOXY-1,2,3,4-TETRAHYDRO-ISOQUINOLIN-1-YL)-PROPANE-1,3-DIOL
CAS No: 98661-43-9 Catalog No: AG0067BL MDL No:
Product Description
Catalog Number:
AG0067BL
Chemical Name:
2-(6,7-DIETHOXY-1,2,3,4-TETRAHYDRO-ISOQUINOLIN-1-YL)-PROPANE-1,3-DIOL
CAS Number:
98661-43-9
Molecular Formula:
C16H25NO4
Molecular Weight:
295.3740
IUPAC Name:
2-(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)propane-1,3-diol
InChI:
InChI=1S/C16H25NO4/c1-3-20-14-7-11-5-6-17-16(12(9-18)10-19)13(11)8-15(14)21-4-2/h7-8,12,16-19H,3-6,9-10H2,1-2H3
InChI Key:
DLPCTIQNIDHILA-UHFFFAOYSA-N
SMILES:
CCOc1cc2c(cc1OCC)CCNC2C(CO)CO
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.178g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
295.379g/mol
Monoisotopic Mass:
295.178g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
71A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.