5-diethoxyphosphoryl-2-methylpent-1-ene

C10H21O3P — CID 11345027

IUPAC5-diethoxyphosphoryl-2-methylpent-1-ene
SMILESC=C(C)CCCP(=O)(OCC)OCC
InChIInChI=1S/C10H21O3P/c1-5-12-14(11,13-6-2)9-7-8-10(3)4/h3,5-9H2,1-2,4H3
InChIKeyVHKOWEUVRJYOQQ-UHFFFAOYSA-N
MW220.25 g/mol
LogP3.61
Rot. Bonds8

About 5-diethoxyphosphoryl-2-methylpent-1-ene

5-diethoxyphosphoryl-2-methylpent-1-ene (PubChem CID 11345027) has the molecular formula C10H21O3P and a molecular weight of 220.25 g/mol. Its IUPAC name is 5-diethoxyphosphoryl-2-methylpent-1-ene.

Molecular Properties

Compound Name5-diethoxyphosphoryl-2-methylpent-1-ene
PubChem CID11345027
Molecular FormulaC10H21O3P
Molecular Weight220.25 g/mol
Exact Mass220.12
IUPAC Name5-diethoxyphosphoryl-2-methylpent-1-ene
SMILESC=C(C)CCCP(=O)(OCC)OCC
InChIInChI=1S/C10H21O3P/c1-5-12-14(11,13-6-2)9-7-8-10(3)4/h3,5-9H2,1-2,4H3
InChIKeyVHKOWEUVRJYOQQ-UHFFFAOYSA-N
XLogP3.61
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.25
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-diethoxyphosphorylhexan-3-one
CID 91326618
4-diethoxyphosphorylbutanehydrazide
CID 156632548
8-diethoxyphosphoryloctan-1-ol
CID 10515886
13-diethoxyphosphoryltridecanoic acid
CID 87637864
11-diethoxyphosphorylundecanoic acid
CID 45158998
1-diethoxyphosphoryldecane
CID 2773697
1,5-bis(diethoxyphosphoryl)pentan-3-one
CID 12030147
1-diethoxyphosphorylundecane
CID 57360026
3-[ethoxy(methoxy)phosphoryl]-2-methylprop-1-ene
CID 142703300
butyl 4-diethoxyphosphorylbutanoate
CID 90341403
ethyl 5-diethoxyphosphorylpentanoate
CID 2773707
3-diethoxyphosphorylpropan-1-amine;oxalic acid
CID 2733597

Frequently Asked Questions

What is the IUPAC name of 5-diethoxyphosphoryl-2-methylpent-1-ene?
The IUPAC name of 5-diethoxyphosphoryl-2-methylpent-1-ene (CID 11345027) is 5-diethoxyphosphoryl-2-methylpent-1-ene.
What is the SMILES notation for 5-diethoxyphosphoryl-2-methylpent-1-ene?
The canonical SMILES for 5-diethoxyphosphoryl-2-methylpent-1-ene is C=C(C)CCCP(=O)(OCC)OCC.
What is the InChIKey of 5-diethoxyphosphoryl-2-methylpent-1-ene?
The InChIKey is VHKOWEUVRJYOQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21O3P/c1-5-12-14(11,13-6-2)9-7-8-10(3)4/h3,5-9H2,1-2,4H3.
What are the key properties of 5-diethoxyphosphoryl-2-methylpent-1-ene?
5-diethoxyphosphoryl-2-methylpent-1-ene has a molecular weight of 220.25 g/mol, XLogP of 3.61, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-diethoxyphosphoryl-2-methylpent-1-ene is sourced from PubChem (CID 11345027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).