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39843-71-5 | 2-Ethyl-1H-indol-4-ol
CAS No: 39843-71-5 Catalog No: AG00I7TI MDL No:
Product Description
Catalog Number:
AG00I7TI
Chemical Name:
2-Ethyl-1H-indol-4-ol
CAS Number:
39843-71-5
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
IUPAC Name:
2-ethyl-1H-indol-4-ol
InChI:
InChI=1S/C10H11NO/c1-2-7-6-8-9(11-7)4-3-5-10(8)12/h3-6,11-12H,2H2,1H3
InChI Key:
YLPQXAKDMDRDIG-UHFFFAOYSA-N
SMILES:
CCc1cc2c([nH]1)cccc2O
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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