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14446-24-3 | 6-Isoquinolinol, 1,2,3,4-tetrahydro-
CAS No: 14446-24-3 Catalog No: AG001JKU MDL No:MFCD01717047
Product Description
Catalog Number:
AG001JKU
Chemical Name:
6-Isoquinolinol, 1,2,3,4-tetrahydro-
CAS Number:
14446-24-3
Molecular Formula:
C9H11NO
Molecular Weight:
149.1897
MDL Number:
MFCD01717047
IUPAC Name:
1,2,3,4-tetrahydroisoquinolin-6-ol
InChI:
InChI=1S/C9H11NO/c11-9-2-1-8-6-10-4-3-7(8)5-9/h1-2,5,10-11H,3-4,6H2
InChI Key:
SCMZIFSYPJICCV-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)CCNC2
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
149.193g/mol
Monoisotopic Mass:
149.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Literature
| Title | Journal |
|---|---|
| Bioactivity-guided mapping and navigation of chemical space. | Nature chemical biology 20090801 |
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