(6Z)-6-hydroxyiminododecan-1-ol

C12H25NO2 — CID 21390327

IUPAC(6Z)-6-hydroxyiminododecan-1-ol
SMILESCCCCCC/C(CCCCCO)=N/O
InChIInChI=1S/C12H25NO2/c1-2-3-4-6-9-12(13-15)10-7-5-8-11-14/h14-15H,2-11H2,1H3/b13-12-
InChIKeyVQNDEWTXJKFFRY-SEYXRHQNSA-N
MW215.34 g/mol
LogP3.34
Rot. Bonds10

About (6Z)-6-hydroxyiminododecan-1-ol

(6Z)-6-hydroxyiminododecan-1-ol (PubChem CID 21390327) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is (6Z)-6-hydroxyiminododecan-1-ol.

Molecular Properties

Compound Name(6Z)-6-hydroxyiminododecan-1-ol
PubChem CID21390327
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name(6Z)-6-hydroxyiminododecan-1-ol
SMILESCCCCCC/C(CCCCCO)=N/O
InChIInChI=1S/C12H25NO2/c1-2-3-4-6-9-12(13-15)10-7-5-8-11-14/h14-15H,2-11H2,1H3/b13-12-
InChIKeyVQNDEWTXJKFFRY-SEYXRHQNSA-N
XLogP3.34
TPSA52.82 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (6Z)-6-hydroxyiminododecan-1-ol?
The IUPAC name of (6Z)-6-hydroxyiminododecan-1-ol (CID 21390327) is (6Z)-6-hydroxyiminododecan-1-ol.
What is the SMILES notation for (6Z)-6-hydroxyiminododecan-1-ol?
The canonical SMILES for (6Z)-6-hydroxyiminododecan-1-ol is CCCCCC/C(CCCCCO)=N/O.
What is the InChIKey of (6Z)-6-hydroxyiminododecan-1-ol?
The InChIKey is VQNDEWTXJKFFRY-SEYXRHQNSA-N. The full InChI is InChI=1S/C12H25NO2/c1-2-3-4-6-9-12(13-15)10-7-5-8-11-14/h14-15H,2-11H2,1H3/b13-12-.
What are the key properties of (6Z)-6-hydroxyiminododecan-1-ol?
(6Z)-6-hydroxyiminododecan-1-ol has a molecular weight of 215.34 g/mol, XLogP of 3.34, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-6-hydroxyiminododecan-1-ol is sourced from PubChem (CID 21390327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).