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Home > Indoles and Oxindole > 2059975-51-6
2059975-51-6 | 3,3-diethyl-2,3-dihydro-1H-indol-5-ol
CAS No: 2059975-51-6 Catalog No: AG01BP9A MDL No:MFCD30499988
Product Description
Catalog Number:
AG01BP9A
Chemical Name:
3,3-diethyl-2,3-dihydro-1H-indol-5-ol
CAS Number:
2059975-51-6
Molecular Formula:
C12H17NO
Molecular Weight:
191.2695
MDL Number:
MFCD30499988
IUPAC Name:
3,3-diethyl-1,2-dihydroindol-5-ol
InChI:
InChI=1S/C12H17NO/c1-3-12(4-2)8-13-11-6-5-9(14)7-10(11)12/h5-7,13-14H,3-4,8H2,1-2H3
InChI Key:
QHAUALVKMKCHDD-UHFFFAOYSA-N
SMILES:
CCC1(CC)CNc2c1cc(O)cc2
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.131g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
191.274g/mol
Monoisotopic Mass:
191.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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