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1159511-15-5 | 8-Isoquinolinemethanol
CAS No: 1159511-15-5 Catalog No: AG000H5E MDL No:MFCD11869736
Product Description
Catalog Number:
AG000H5E
Chemical Name:
8-Isoquinolinemethanol
CAS Number:
1159511-15-5
Molecular Formula:
C10H9NO
Molecular Weight:
159.1846
MDL Number:
MFCD11869736
IUPAC Name:
isoquinolin-8-ylmethanol
InChI:
InChI=1S/C10H9NO/c12-7-9-3-1-2-8-4-5-11-6-10(8)9/h1-6,12H,7H2
InChI Key:
UDNDYRZGZAWJHB-UHFFFAOYSA-N
SMILES:
OCc1cccc2c1cncc2
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.068g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
159.188g/mol
Monoisotopic Mass:
159.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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