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13691-36-6 | 1,2,3,4-Tetrahydro-isoquinolin-4-ol hydrochloride
CAS No: 13691-36-6 Catalog No: AG009K0P MDL No:MFCD18459225
Product Description
Catalog Number:
AG009K0P
Chemical Name:
1,2,3,4-Tetrahydro-isoquinolin-4-ol hydrochloride
CAS Number:
13691-36-6
Molecular Formula:
C9H12ClNO
Molecular Weight:
185.6507
MDL Number:
MFCD18459225
IUPAC Name:
1,2,3,4-tetrahydroisoquinolin-4-ol;hydrochloride
InChI:
InChI=1S/C9H11NO.ClH/c11-9-6-10-5-7-3-1-2-4-8(7)9;/h1-4,9-11H,5-6H2;1H
InChI Key:
GMTJSBDABPOTQP-UHFFFAOYSA-N
SMILES:
OC1CNCc2c1cccc2.Cl
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.061g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
185.651g/mol
Monoisotopic Mass:
185.061g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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