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63937-92-8 | 2-METHYL-1,2,3,4-TETRAHYDRO-6,7-ISOQUINOLINEDIOL HYDROCHLORIDE
CAS No: 63937-92-8 Catalog No: AG00E9FZ MDL No:
Product Description
Catalog Number:
AG00E9FZ
Chemical Name:
2-METHYL-1,2,3,4-TETRAHYDRO-6,7-ISOQUINOLINEDIOL HYDROCHLORIDE
CAS Number:
63937-92-8
Molecular Formula:
C10H14ClNO2
Molecular Weight:
215.6767
IUPAC Name:
2-methyl-3,4-dihydro-1H-isoquinoline-6,7-diol;hydrochloride
InChI:
InChI=1S/C10H13NO2.ClH/c1-11-3-2-7-4-9(12)10(13)5-8(7)6-11;/h4-5,12-13H,2-3,6H2,1H3;1H
InChI Key:
URMJNZMQXGBIFX-UHFFFAOYSA-N
SMILES:
CN1CCc2c(C1)cc(c(c2)O)O.Cl
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.071g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
215.677g/mol
Monoisotopic Mass:
215.071g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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