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1673-81-0 | 1-Isoquinolinemethanol, 6,7-dimethoxy-
CAS No: 1673-81-0 Catalog No: AG001XAA MDL No:
Product Description
Catalog Number:
AG001XAA
Chemical Name:
1-Isoquinolinemethanol, 6,7-dimethoxy-
CAS Number:
1673-81-0
Molecular Formula:
C12H13NO3
Molecular Weight:
219.2365
IUPAC Name:
(6,7-dimethoxyisoquinolin-1-yl)methanol
InChI:
InChI=1S/C12H13NO3/c1-15-11-5-8-3-4-13-10(7-14)9(8)6-12(11)16-2/h3-6,14H,7H2,1-2H3
InChI Key:
XIUMQHXAKKTBBK-UHFFFAOYSA-N
SMILES:
COc1cc2c(CO)nccc2cc1OC
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.24g/mol
Monoisotopic Mass:
219.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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