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91098-07-6 | 1H-Pyrrolo[2,3-b]quinolin-4-ol, 2,3,3a,4-tetrahydro-1-methyl-
CAS No: 91098-07-6 Catalog No: AG006EBG MDL No:
Product Description
Catalog Number:
AG006EBG
Chemical Name:
1H-Pyrrolo[2,3-b]quinolin-4-ol, 2,3,3a,4-tetrahydro-1-methyl-
CAS Number:
91098-07-6
Molecular Formula:
C12H14N2O
Molecular Weight:
202.2524
IUPAC Name:
1-methyl-2,3,3a,4-tetrahydropyrrolo[2,3-b]quinolin-4-ol
InChI:
InChI=1S/C12H14N2O/c1-14-7-6-9-11(15)8-4-2-3-5-10(8)13-12(9)14/h2-5,9,11,15H,6-7H2,1H3
InChI Key:
HMDALTDESUYDHO-UHFFFAOYSA-N
SMILES:
CN1CCC2C1=Nc1ccccc1C2O
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.257g/mol
Monoisotopic Mass:
202.111g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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