[(Z)-hept-1-enyl]-hydroxy-oxophosphanium

C7H14O2P+ — CID 23271383

IUPAC[(Z)-hept-1-enyl]-hydroxy-oxophosphanium
SMILESCCCCC/C=C\[P+](=O)O
InChIInChI=1S/C7H13O2P/c1-2-3-4-5-6-7-10(8)9/h6-7H,2-5H2,1H3/p+1/b7-6-
InChIKeyLWRBECXJKLHVJP-SREVYHEPSA-O
MW161.16 g/mol
LogP2.82
Rot. Bonds5

About [(Z)-hept-1-enyl]-hydroxy-oxophosphanium

[(Z)-hept-1-enyl]-hydroxy-oxophosphanium (PubChem CID 23271383) has the molecular formula C7H14O2P+ and a molecular weight of 161.16 g/mol. Its IUPAC name is [(Z)-hept-1-enyl]-hydroxy-oxophosphanium.

Molecular Properties

Compound Name[(Z)-hept-1-enyl]-hydroxy-oxophosphanium
PubChem CID23271383
Molecular FormulaC7H14O2P+
Molecular Weight161.16 g/mol
Exact Mass161.07
IUPAC Name[(Z)-hept-1-enyl]-hydroxy-oxophosphanium
SMILESCCCCC/C=C\[P+](=O)O
InChIInChI=1S/C7H13O2P/c1-2-3-4-5-6-7-10(8)9/h6-7H,2-5H2,1H3/p+1/b7-6-
InChIKeyLWRBECXJKLHVJP-SREVYHEPSA-O
XLogP2.82
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.16
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

dihydroxy(oxo)phosphanium;octadec-9-enylazanium
CID 57351234
chromium;hydroxy-[(Z)-octadec-9-enyl]-oxophosphanium
CID 87139944
CID 131882023
CID 131882023
chromium;hydroxy-octadec-9-enoyl-oxophosphanium
CID 173015672
carbonic acid;(Z)-octadec-9-ene
CID 87599003
nonacos-7-ene
CID 71381021
(Z)-triacont-9-ene
CID 57484178
hexacont-21-ene
CID 54293076
pentacos-9-ene
CID 25201650
(Z)-heptadec-8-ene
CID 5352243
(6E,10Z,14E)-icosa-6,10,14-triene
CID 53230462
(E)-hexadec-6-ene
CID 5352260

Frequently Asked Questions

What is the IUPAC name of [(Z)-hept-1-enyl]-hydroxy-oxophosphanium?
The IUPAC name of [(Z)-hept-1-enyl]-hydroxy-oxophosphanium (CID 23271383) is [(Z)-hept-1-enyl]-hydroxy-oxophosphanium.
What is the SMILES notation for [(Z)-hept-1-enyl]-hydroxy-oxophosphanium?
The canonical SMILES for [(Z)-hept-1-enyl]-hydroxy-oxophosphanium is CCCCC/C=C\[P+](=O)O.
What is the InChIKey of [(Z)-hept-1-enyl]-hydroxy-oxophosphanium?
The InChIKey is LWRBECXJKLHVJP-SREVYHEPSA-O. The full InChI is InChI=1S/C7H13O2P/c1-2-3-4-5-6-7-10(8)9/h6-7H,2-5H2,1H3/p+1/b7-6-.
What are the key properties of [(Z)-hept-1-enyl]-hydroxy-oxophosphanium?
[(Z)-hept-1-enyl]-hydroxy-oxophosphanium has a molecular weight of 161.16 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-hept-1-enyl]-hydroxy-oxophosphanium is sourced from PubChem (CID 23271383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).