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Home > Indoles and Oxindole > 1368793-87-6
1368793-87-6 | 7-ETHYL-3,3-DIMETHYL-2,3-DIHYDRO-1H-INDOLE
CAS No: 1368793-87-6 Catalog No: AG01BP8A MDL No:MFCD21876671
Product Description
Catalog Number:
AG01BP8A
Chemical Name:
7-ETHYL-3,3-DIMETHYL-2,3-DIHYDRO-1H-INDOLE
CAS Number:
1368793-87-6
Molecular Formula:
C12H17N
Molecular Weight:
175.2701
MDL Number:
MFCD21876671
IUPAC Name:
7-ethyl-3,3-dimethyl-1,2-dihydroindole
InChI:
InChI=1S/C12H17N/c1-4-9-6-5-7-10-11(9)13-8-12(10,2)3/h5-7,13H,4,8H2,1-3H3
InChI Key:
NGCPNHIUKAFNRL-UHFFFAOYSA-N
SMILES:
CCc1cccc2c1NCC2(C)C
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.136g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.275g/mol
Monoisotopic Mass:
175.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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