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3395-21-9 | 6,9,10-Trimethoxy-12H-benz(6,7)oxepino(2,3,4-i,j)isoquinoline
CAS No: 3395-21-9 Catalog No: AG00CZMT MDL No:
Product Description
Catalog Number:
AG00CZMT
Chemical Name:
6,9,10-Trimethoxy-12H-benz(6,7)oxepino(2,3,4-i,j)isoquinoline
CAS Number:
3395-21-9
IUPAC Name:
5,6,17-trimethoxy-2-oxa-11-azatetracyclo[8.7.1.03,8.014,18]octadeca-1(17),3,5,7,10,12,14(18),15-octaene
InChI:
InChI=1S/C19H17NO4/c1-21-14-5-4-11-6-7-20-13-8-12-9-16(22-2)17(23-3)10-15(12)24-19(14)18(11)13/h4-7,9-10H,8H2,1-3H3
InChI Key:
JFPRPRGBOXZMMH-UHFFFAOYSA-N
Properties
Complexity:
434
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.116g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.348g/mol
Monoisotopic Mass:
323.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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