(6Z,8E,10Z,12E)-cyclopenta[12]annulen-3a-ol

C15H14O — CID 173036066

IUPAC(6Z,8E,10Z,12E)-cyclopenta[12]annulen-3a-ol
SMILESOC12C=CC=C1/C=C/C=C\C=C\C=C/C=C2
InChIInChI=1S/C15H14O/c16-15-12-8-6-4-2-1-3-5-7-10-14(15)11-9-13-15/h1-13,16H/b2-1+,5-3-,6-4-,10-7+,12-8?
InChIKeyKCBVEVDOXUWBIA-CDRQVFAISA-N
MW210.28 g/mol
LogP3.01
Rot. Bonds

About (6Z,8E,10Z,12E)-cyclopenta[12]annulen-3a-ol

(6Z,8E,10Z,12E)-cyclopenta[12]annulen-3a-ol (PubChem CID 173036066) has the molecular formula C15H14O and a molecular weight of 210.28 g/mol. Its IUPAC name is (6Z,8E,10Z,12E)-cyclopenta[12]annulen-3a-ol.

Molecular Properties

Compound Name(6Z,8E,10Z,12E)-cyclopenta[12]annulen-3a-ol
PubChem CID173036066
Molecular FormulaC15H14O
Molecular Weight210.28 g/mol
Exact Mass210.10
IUPAC Name(6Z,8E,10Z,12E)-cyclopenta[12]annulen-3a-ol
SMILESOC12C=CC=C1/C=C/C=C\C=C\C=C/C=C2
InChIInChI=1S/C15H14O/c16-15-12-8-6-4-2-1-3-5-7-10-14(15)11-9-13-15/h1-13,16H/b2-1+,5-3-,6-4-,10-7+,12-8?
InChIKeyKCBVEVDOXUWBIA-CDRQVFAISA-N
XLogP3.01
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (6Z,8E,10Z,12E)-cyclopenta[12]annulen-3a-ol?
The IUPAC name of (6Z,8E,10Z,12E)-cyclopenta[12]annulen-3a-ol (CID 173036066) is (6Z,8E,10Z,12E)-cyclopenta[12]annulen-3a-ol.
What is the SMILES notation for (6Z,8E,10Z,12E)-cyclopenta[12]annulen-3a-ol?
The canonical SMILES for (6Z,8E,10Z,12E)-cyclopenta[12]annulen-3a-ol is OC12C=CC=C1/C=C/C=C\C=C\C=C/C=C2.
What is the InChIKey of (6Z,8E,10Z,12E)-cyclopenta[12]annulen-3a-ol?
The InChIKey is KCBVEVDOXUWBIA-CDRQVFAISA-N. The full InChI is InChI=1S/C15H14O/c16-15-12-8-6-4-2-1-3-5-7-10-14(15)11-9-13-15/h1-13,16H/b2-1+,5-3-,6-4-,10-7+,12-8?.
What are the key properties of (6Z,8E,10Z,12E)-cyclopenta[12]annulen-3a-ol?
(6Z,8E,10Z,12E)-cyclopenta[12]annulen-3a-ol has a molecular weight of 210.28 g/mol, XLogP of 3.01, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z,8E,10Z,12E)-cyclopenta[12]annulen-3a-ol is sourced from PubChem (CID 173036066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).