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14097-39-3 | 6-Isoquinolinol, 1,2,3,4-tetrahydro-2-methyl-
CAS No: 14097-39-3 Catalog No: AG001FP8 MDL No:MFCD01444792
Product Description
Catalog Number:
AG001FP8
Chemical Name:
6-Isoquinolinol, 1,2,3,4-tetrahydro-2-methyl-
CAS Number:
14097-39-3
Molecular Formula:
C10H13NO
Molecular Weight:
163.2163
MDL Number:
MFCD01444792
IUPAC Name:
2-methyl-3,4-dihydro-1H-isoquinolin-6-ol
InChI:
InChI=1S/C10H13NO/c1-11-5-4-8-6-10(12)3-2-9(8)7-11/h2-3,6,12H,4-5,7H2,1H3
InChI Key:
BMLTXAQSFDCMHA-UHFFFAOYSA-N
SMILES:
CN1CCc2c(C1)ccc(c2)O
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.1g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
163.22g/mol
Monoisotopic Mass:
163.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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