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Home > Indoles and Oxindole > 78839-81-3
78839-81-3 | Cyclopent[b]indol-8b(1H)-ol, 2,3,3a,4-tetrahydro-, cis-
CAS No: 78839-81-3 Catalog No: AG005P4A MDL No:
Product Description
Catalog Number:
AG005P4A
Chemical Name:
Cyclopent[b]indol-8b(1H)-ol, 2,3,3a,4-tetrahydro-, cis-
CAS Number:
78839-81-3
Molecular Formula:
C11H13NO
Molecular Weight:
175.2270
IUPAC Name:
(3aR,8bS)-2,3,3a,4-tetrahydro-1H-cyclopenta[b]indol-8b-ol
InChI:
InChI=1S/C11H13NO/c13-11-7-3-6-10(11)12-9-5-2-1-4-8(9)11/h1-2,4-5,10,12-13H,3,6-7H2/t10-,11+/m1/s1
InChI Key:
VBXPCHYQCGQELT-MNOVXSKESA-N
SMILES:
O[C@]12CCC[C@H]1Nc1c2cccc1
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
175.1g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
175.231g/mol
Monoisotopic Mass:
175.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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