(4Z)-10,10-dichlorobicyclo[6.2.0]dec-4-en-9-ol

C10H14Cl2O — CID 129274187

IUPAC(4Z)-10,10-dichlorobicyclo[6.2.0]dec-4-en-9-ol
SMILESOC1C2CC/C=C\CCC2C1(Cl)Cl
InChIInChI=1S/C10H14Cl2O/c11-10(12)8-6-4-2-1-3-5-7(8)9(10)13/h1-2,7-9,13H,3-6H2/b2-1-
InChIKeyPBTHGJMDAAWBSB-UPHRSURJSA-N
MW221.13 g/mol
LogP2.90
Rot. Bonds

About (4Z)-10,10-dichlorobicyclo[6.2.0]dec-4-en-9-ol

(4Z)-10,10-dichlorobicyclo[6.2.0]dec-4-en-9-ol (PubChem CID 129274187) has the molecular formula C10H14Cl2O and a molecular weight of 221.13 g/mol. Its IUPAC name is (4Z)-10,10-dichlorobicyclo[6.2.0]dec-4-en-9-ol.

Molecular Properties

Compound Name(4Z)-10,10-dichlorobicyclo[6.2.0]dec-4-en-9-ol
PubChem CID129274187
Molecular FormulaC10H14Cl2O
Molecular Weight221.13 g/mol
Exact Mass220.04
IUPAC Name(4Z)-10,10-dichlorobicyclo[6.2.0]dec-4-en-9-ol
SMILESOC1C2CC/C=C\CCC2C1(Cl)Cl
InChIInChI=1S/C10H14Cl2O/c11-10(12)8-6-4-2-1-3-5-7(8)9(10)13/h1-2,7-9,13H,3-6H2/b2-1-
InChIKeyPBTHGJMDAAWBSB-UPHRSURJSA-N
XLogP2.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.13
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (4Z)-10,10-dichlorobicyclo[6.2.0]dec-4-en-9-ol?
The IUPAC name of (4Z)-10,10-dichlorobicyclo[6.2.0]dec-4-en-9-ol (CID 129274187) is (4Z)-10,10-dichlorobicyclo[6.2.0]dec-4-en-9-ol.
What is the SMILES notation for (4Z)-10,10-dichlorobicyclo[6.2.0]dec-4-en-9-ol?
The canonical SMILES for (4Z)-10,10-dichlorobicyclo[6.2.0]dec-4-en-9-ol is OC1C2CC/C=C\CCC2C1(Cl)Cl.
What is the InChIKey of (4Z)-10,10-dichlorobicyclo[6.2.0]dec-4-en-9-ol?
The InChIKey is PBTHGJMDAAWBSB-UPHRSURJSA-N. The full InChI is InChI=1S/C10H14Cl2O/c11-10(12)8-6-4-2-1-3-5-7(8)9(10)13/h1-2,7-9,13H,3-6H2/b2-1-.
What are the key properties of (4Z)-10,10-dichlorobicyclo[6.2.0]dec-4-en-9-ol?
(4Z)-10,10-dichlorobicyclo[6.2.0]dec-4-en-9-ol has a molecular weight of 221.13 g/mol, XLogP of 2.90, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-10,10-dichlorobicyclo[6.2.0]dec-4-en-9-ol is sourced from PubChem (CID 129274187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).