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91623-77-7 | 6,7,8,9-TETRAHYDRO-1,3,8-TRIMETHYL-3H-PYRAZOLO[3,4-C]ISOQUINOLINE
CAS No: 91623-77-7 Catalog No: AG006FLQ MDL No:
Product Description
Catalog Number:
AG006FLQ
Chemical Name:
6,7,8,9-TETRAHYDRO-1,3,8-TRIMETHYL-3H-PYRAZOLO[3,4-C]ISOQUINOLINE
CAS Number:
91623-77-7
Molecular Formula:
C13H17N3
Molecular Weight:
215.2942
IUPAC Name:
1,3,8-trimethyl-6,7,8,9-tetrahydropyrazolo[3,4-c]isoquinoline
InChI:
InChI=1S/C13H17N3/c1-8-4-5-10-7-14-13-12(11(10)6-8)9(2)15-16(13)3/h7-8H,4-6H2,1-3H3
InChI Key:
GCAAZSZRBPPJJY-UHFFFAOYSA-N
SMILES:
CC1CCc2c(C1)c1c(C)nn(c1nc2)C
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.142g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.3g/mol
Monoisotopic Mass:
215.142g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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