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94914-42-8 | Isoquinoline,6,7-diethoxy-1,2,3,4-tetrahydro-1-phenyl-
CAS No: 94914-42-8 Catalog No: AG00IINE MDL No:
Product Description
Catalog Number:
AG00IINE
Chemical Name:
Isoquinoline,6,7-diethoxy-1,2,3,4-tetrahydro-1-phenyl-
CAS Number:
94914-42-8
IUPAC Name:
6,7-diethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline
InChI:
InChI=1S/C19H23NO2/c1-3-21-17-12-15-10-11-20-19(14-8-6-5-7-9-14)16(15)13-18(17)22-4-2/h5-9,12-13,19-20H,3-4,10-11H2,1-2H3
InChI Key:
DRUZNOUZPRHPOS-UHFFFAOYSA-N
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.173g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
297.398g/mol
Monoisotopic Mass:
297.173g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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