fluoro-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]phosphinic acid

C8H12FO2P — CID 142143106

IUPACfluoro-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]phosphinic acid
SMILESC=C/C=C(\C=C/C)CP(=O)(O)F
InChIInChI=1S/C8H12FO2P/c1-3-5-8(6-4-2)7-12(9,10)11/h3-6H,1,7H2,2H3,(H,10,11)/b6-4-,8-5+
InChIKeyUXWPEAXKBZOXPJ-QXMOYCCXSA-N
MW190.15 g/mol
LogP2.83
Rot. Bonds4

About fluoro-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]phosphinic acid

fluoro-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]phosphinic acid (PubChem CID 142143106) has the molecular formula C8H12FO2P and a molecular weight of 190.15 g/mol. Its IUPAC name is fluoro-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]phosphinic acid.

Molecular Properties

Compound Namefluoro-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]phosphinic acid
PubChem CID142143106
Molecular FormulaC8H12FO2P
Molecular Weight190.15 g/mol
Exact Mass190.06
IUPAC Namefluoro-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]phosphinic acid
SMILESC=C/C=C(\C=C/C)CP(=O)(O)F
InChIInChI=1S/C8H12FO2P/c1-3-5-8(6-4-2)7-12(9,10)11/h3-6H,1,7H2,2H3,(H,10,11)/b6-4-,8-5+
InChIKeyUXWPEAXKBZOXPJ-QXMOYCCXSA-N
XLogP2.83
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.15
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]phosphonic acid
CID 10353790
[(2E)-2-ethyl-4,5-dimethylhexa-2,4-dienyl]-(fluoromethyl)phosphinic acid
CID 143340153
[(1E,3E,7E)-4,8,12-trimethyltrideca-1,3,7,11-tetraenyl]phosphonic acid
CID 10017574
[(2E)-4-methylpenta-2,4-dien-2-yl]phosphonic acid
CID 20403109
4-Ethylhexa-1,3-dien-3-ylphosphonic acid
CID 21694310
[(2E,4E,6E)-3,7,11-trimethyldodeca-2,4,6,10-tetraenyl]phosphonic acid
CID 21835318
[(4E,6E)-3,7,11-trimethyldodeca-1,2,4,6,10-pentaenyl]phosphonic acid
CID 21835319
[(2Z)-4-methylpenta-2,4-dien-2-yl]phosphonic acid
CID 53375251
4,8-Dimethylnona-1,3,7-trienylphosphonic acid
CID 53842691
3,7,11-Trimethyldodeca-1,2,4,6,10-pentaenylphosphonic acid
CID 54148241
3,7,11-Trimethyl-2,4,6,10-dodecatetraenyl-phosphonic acid
CID 54211224
(4-Methylpenta-2,4-dien-2-yl)phosphonic acid
CID 54322802

Frequently Asked Questions

What is the IUPAC name of fluoro-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]phosphinic acid?
The IUPAC name of fluoro-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]phosphinic acid (CID 142143106) is fluoro-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]phosphinic acid.
What is the SMILES notation for fluoro-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]phosphinic acid?
The canonical SMILES for fluoro-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]phosphinic acid is C=C/C=C(\C=C/C)CP(=O)(O)F.
What is the InChIKey of fluoro-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]phosphinic acid?
The InChIKey is UXWPEAXKBZOXPJ-QXMOYCCXSA-N. The full InChI is InChI=1S/C8H12FO2P/c1-3-5-8(6-4-2)7-12(9,10)11/h3-6H,1,7H2,2H3,(H,10,11)/b6-4-,8-5+.
What are the key properties of fluoro-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]phosphinic acid?
fluoro-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]phosphinic acid has a molecular weight of 190.15 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]phosphinic acid is sourced from PubChem (CID 142143106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).