(Z)-1-diethoxyphosphoryl-1,3-difluorohex-2-ene

C10H19F2O3P — CID 15499030

IUPAC(Z)-1-diethoxyphosphoryl-1,3-difluorohex-2-ene
SMILESCCC/C(F)=C/C(F)P(=O)(OCC)OCC
InChIInChI=1S/C10H19F2O3P/c1-4-7-9(11)8-10(12)16(13,14-5-2)15-6-3/h8,10H,4-7H2,1-3H3/b9-8-
InChIKeyNADHOEOKKDRCNP-HJWRWDBZSA-N
MW256.23 g/mol
LogP4.20
Rot. Bonds8

About (Z)-1-diethoxyphosphoryl-1,3-difluorohex-2-ene

(Z)-1-diethoxyphosphoryl-1,3-difluorohex-2-ene (PubChem CID 15499030) has the molecular formula C10H19F2O3P and a molecular weight of 256.23 g/mol. Its IUPAC name is (Z)-1-diethoxyphosphoryl-1,3-difluorohex-2-ene.

Molecular Properties

Compound Name(Z)-1-diethoxyphosphoryl-1,3-difluorohex-2-ene
PubChem CID15499030
Molecular FormulaC10H19F2O3P
Molecular Weight256.23 g/mol
Exact Mass256.10
IUPAC Name(Z)-1-diethoxyphosphoryl-1,3-difluorohex-2-ene
SMILESCCC/C(F)=C/C(F)P(=O)(OCC)OCC
InChIInChI=1S/C10H19F2O3P/c1-4-7-9(11)8-10(12)16(13,14-5-2)15-6-3/h8,10H,4-7H2,1-3H3/b9-8-
InChIKeyNADHOEOKKDRCNP-HJWRWDBZSA-N
XLogP4.20
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.23
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

((E)-1,1-Difluoro-hept-2-enyl)-phosphonic acid diethyl ester
CID 10539959
(Z)-1-diethoxyphosphoryl-1-fluorooct-2-ene
CID 100929330
(E)-1-diethoxyphosphoryl-3-fluorohex-1-ene
CID 11322355
(E)-1-diethoxyphosphoryl-3-fluorobut-1-ene
CID 13635635
(E)-5-diethoxyphosphoryl-5,5-difluoropent-2-ene
CID 14268060
(E)-1-diethoxyphosphoryl-1-fluoronon-2-ene
CID 15449246
(Z)-5-diethoxyphosphoryl-5,5-difluoropent-2-ene
CID 139264136
(E)-1-diethoxyphosphoryloct-2-ene
CID 10444695
Diethoxyphosphorylcyclopentene
CID 10774533
(E)-2-diethoxyphosphorylpent-2-ene
CID 13613003
4-Diethoxyphosphoryl-4-fluorobut-1-ene
CID 10774791
(E)-5-diethoxyphosphoryl-5-fluoropent-2-ene
CID 10775488

Frequently Asked Questions

What is the IUPAC name of (Z)-1-diethoxyphosphoryl-1,3-difluorohex-2-ene?
The IUPAC name of (Z)-1-diethoxyphosphoryl-1,3-difluorohex-2-ene (CID 15499030) is (Z)-1-diethoxyphosphoryl-1,3-difluorohex-2-ene.
What is the SMILES notation for (Z)-1-diethoxyphosphoryl-1,3-difluorohex-2-ene?
The canonical SMILES for (Z)-1-diethoxyphosphoryl-1,3-difluorohex-2-ene is CCC/C(F)=C/C(F)P(=O)(OCC)OCC.
What is the InChIKey of (Z)-1-diethoxyphosphoryl-1,3-difluorohex-2-ene?
The InChIKey is NADHOEOKKDRCNP-HJWRWDBZSA-N. The full InChI is InChI=1S/C10H19F2O3P/c1-4-7-9(11)8-10(12)16(13,14-5-2)15-6-3/h8,10H,4-7H2,1-3H3/b9-8-.
What are the key properties of (Z)-1-diethoxyphosphoryl-1,3-difluorohex-2-ene?
(Z)-1-diethoxyphosphoryl-1,3-difluorohex-2-ene has a molecular weight of 256.23 g/mol, XLogP of 4.20, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-diethoxyphosphoryl-1,3-difluorohex-2-ene is sourced from PubChem (CID 15499030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).