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Home > Indoles and Oxindole > 18134-07-1
18134-07-1 | 1H-Indole-2-propanol, octahydro-1-methyl-
CAS No: 18134-07-1 Catalog No: AG0022UX MDL No:
Product Description
Catalog Number:
AG0022UX
Chemical Name:
1H-Indole-2-propanol, octahydro-1-methyl-
CAS Number:
18134-07-1
Molecular Formula:
C12H23NO
Molecular Weight:
197.3171
IUPAC Name:
3-(1-methyl-2,3,3a,4,5,6,7,7a-octahydroindol-2-yl)propan-1-ol
InChI:
InChI=1S/C12H23NO/c1-13-11(6-4-8-14)9-10-5-2-3-7-12(10)13/h10-12,14H,2-9H2,1H3
InChI Key:
JPAMOXADGQHRRV-UHFFFAOYSA-N
SMILES:
OCCCC1CC2C(N1C)CCCC2
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.178g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.322g/mol
Monoisotopic Mass:
197.178g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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