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Home > Indoles and Oxindole > 36729-22-3
36729-22-3 | 2,3-dimethyl-1H-indol-5-ol
CAS No: 36729-22-3 Catalog No: AG01BGOT MDL No:MFCD24551619
Product Description
Catalog Number:
AG01BGOT
Chemical Name:
2,3-dimethyl-1H-indol-5-ol
CAS Number:
36729-22-3
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
MDL Number:
MFCD24551619
IUPAC Name:
2,3-dimethyl-1H-indol-5-ol
InChI:
InChI=1S/C10H11NO/c1-6-7(2)11-10-4-3-8(12)5-9(6)10/h3-5,11-12H,1-2H3
InChI Key:
WNQDMVUJDKZHEC-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)c(C)c([nH]2)C
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
161.204g/mol
Monoisotopic Mass:
161.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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