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392334-36-0 | 6,7-Isoquinolinediol, 1-(1-methylethyl)- (9CI)
CAS No: 392334-36-0 Catalog No: AG00CZ39 MDL No:
Product Description
Catalog Number:
AG00CZ39
Chemical Name:
6,7-Isoquinolinediol, 1-(1-methylethyl)- (9CI)
CAS Number:
392334-36-0
IUPAC Name:
1-propan-2-ylisoquinoline-6,7-diol
InChI:
InChI=1S/C12H13NO2/c1-7(2)12-9-6-11(15)10(14)5-8(9)3-4-13-12/h3-7,14-15H,1-2H3
InChI Key:
UHTWPAJMBXFYQC-UHFFFAOYSA-N
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
203.241g/mol
Monoisotopic Mass:
203.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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