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Home > Indoles and Oxindole > 1194-58-7
1194-58-7 | 1H-Indole, octahydro-1-methyl-, cis- (9CI)
CAS No: 1194-58-7 Catalog No: AG000IPP MDL No:
Product Description
Catalog Number:
AG000IPP
Chemical Name:
1H-Indole, octahydro-1-methyl-, cis- (9CI)
CAS Number:
1194-58-7
Molecular Formula:
C9H17N
Molecular Weight:
139.2380
IUPAC Name:
(3aS,7aS)-1-methyl-2,3,3a,4,5,6,7,7a-octahydroindole
InChI:
InChI=1S/C9H17N/c1-10-7-6-8-4-2-3-5-9(8)10/h8-9H,2-7H2,1H3/t8-,9-/m0/s1
InChI Key:
AWTMNUUIQAMREG-IUCAKERBSA-N
SMILES:
CN1CC[C@H]2[C@@H]1CCCC2
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
139.136g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
139.242g/mol
Monoisotopic Mass:
139.136g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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