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Home > Indoles and Oxindole > 52098-27-8
52098-27-8 | 1-(1H-indol-2-yl)ethan-1-ol
CAS No: 52098-27-8 Catalog No: AG01A4CU MDL No:MFCD00558464
Product Description
Catalog Number:
AG01A4CU
Chemical Name:
1-(1H-indol-2-yl)ethan-1-ol
CAS Number:
52098-27-8
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
MDL Number:
MFCD00558464
IUPAC Name:
1-(1H-indol-2-yl)ethanol
InChI:
InChI=1S/C10H11NO/c1-7(12)10-6-8-4-2-3-5-9(8)11-10/h2-7,11-12H,1H3
InChI Key:
AYDNGOXYPCMWIS-UHFFFAOYSA-N
SMILES:
CC(c1cc2c([nH]1)cccc2)O
Properties
Complexity:
160
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:
1
Topological Polar Surface Area:
36A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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