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Home > Indoles and Oxindole > 87401-41-0
87401-41-0 | 1H-Indole, octahydro-1,3-dimethyl-
CAS No: 87401-41-0 Catalog No: AG004N97 MDL No:
Product Description
Catalog Number:
AG004N97
Chemical Name:
1H-Indole, octahydro-1,3-dimethyl-
CAS Number:
87401-41-0
Molecular Formula:
C10H19N
Molecular Weight:
153.2646
IUPAC Name:
1,3-dimethyl-2,3,3a,4,5,6,7,7a-octahydroindole
InChI:
InChI=1S/C10H19N/c1-8-7-11(2)10-6-4-3-5-9(8)10/h8-10H,3-7H2,1-2H3
InChI Key:
QORCSZLKHJMGFR-UHFFFAOYSA-N
SMILES:
CN1CC(C2C1CCCC2)C
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.152g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.269g/mol
Monoisotopic Mass:
153.152g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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