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447433-43-4 | 6,7-Isoquinolinediol, 3,4-dihydro-1-(1-methylethyl)- (9CI)
CAS No: 447433-43-4 Catalog No: AG00DZ8F MDL No:
Product Description
Catalog Number:
AG00DZ8F
Chemical Name:
6,7-Isoquinolinediol, 3,4-dihydro-1-(1-methylethyl)- (9CI)
CAS Number:
447433-43-4
IUPAC Name:
1-propan-2-yl-3,4-dihydroisoquinoline-6,7-diol
InChI:
InChI=1S/C12H15NO2/c1-7(2)12-9-6-11(15)10(14)5-8(9)3-4-13-12/h5-7,14-15H,3-4H2,1-2H3
InChI Key:
BGWWZJVIBUPAAB-UHFFFAOYSA-N
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.11g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
205.257g/mol
Monoisotopic Mass:
205.11g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
52.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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