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Home > Indoles and Oxindole > 13314-85-7
13314-85-7 | 1H-Indol-5-ol, 2-methyl-
CAS No: 13314-85-7 Catalog No: AG0014BH MDL No:MFCD00022714
Product Description
Catalog Number:
AG0014BH
Chemical Name:
1H-Indol-5-ol, 2-methyl-
CAS Number:
13314-85-7
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
MDL Number:
MFCD00022714
IUPAC Name:
2-methyl-1H-indol-5-ol
InChI:
InChI=1S/C9H9NO/c1-6-4-7-5-8(11)2-3-9(7)10-6/h2-5,10-11H,1H3
InChI Key:
MDWJZBVEVLTXDE-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)cc([nH]2)C
EC Number:
236-345-0
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.068g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
147.177g/mol
Monoisotopic Mass:
147.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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