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Home > Indoles and Oxindole > 1558247-97-4
1558247-97-4 | 5-methyl-3-propyl-2,3-dihydro-1H-indole
CAS No: 1558247-97-4 Catalog No: AG01BP6M MDL No:MFCD30499929
Product Description
Catalog Number:
AG01BP6M
Chemical Name:
5-methyl-3-propyl-2,3-dihydro-1H-indole
CAS Number:
1558247-97-4
Molecular Formula:
C12H17N
Molecular Weight:
175.2701
MDL Number:
MFCD30499929
IUPAC Name:
5-methyl-3-propyl-2,3-dihydro-1H-indole
InChI:
InChI=1S/C12H17N/c1-3-4-10-8-13-12-6-5-9(2)7-11(10)12/h5-7,10,13H,3-4,8H2,1-2H3
InChI Key:
SHLCEYSMKMRBMV-UHFFFAOYSA-N
SMILES:
CCCC1CNc2c1cc(C)cc2
Properties
Complexity:
167
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:
2
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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