5-dichlorophosphoryl-2-methylpent-2-ene

C6H11Cl2OP — CID 171108038

IUPAC5-dichlorophosphoryl-2-methylpent-2-ene
SMILESCC(C)=CCCP(=O)(Cl)Cl
InChIInChI=1S/C6H11Cl2OP/c1-6(2)4-3-5-10(7,8)9/h4H,3,5H2,1-2H3
InChIKeyUCLYEUTWBJAYBR-UHFFFAOYSA-N
MW201.03 g/mol
LogP4.01
Rot. Bonds3

About 5-dichlorophosphoryl-2-methylpent-2-ene

5-dichlorophosphoryl-2-methylpent-2-ene (PubChem CID 171108038) has the molecular formula C6H11Cl2OP and a molecular weight of 201.03 g/mol. Its IUPAC name is 5-dichlorophosphoryl-2-methylpent-2-ene.

Molecular Properties

Compound Name5-dichlorophosphoryl-2-methylpent-2-ene
PubChem CID171108038
Molecular FormulaC6H11Cl2OP
Molecular Weight201.03 g/mol
Exact Mass199.99
IUPAC Name5-dichlorophosphoryl-2-methylpent-2-ene
SMILESCC(C)=CCCP(=O)(Cl)Cl
InChIInChI=1S/C6H11Cl2OP/c1-6(2)4-3-5-10(7,8)9/h4H,3,5H2,1-2H3
InChIKeyUCLYEUTWBJAYBR-UHFFFAOYSA-N
XLogP4.01
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.03
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-4-chloro-1-dichlorophosphoryl-2-methylbut-2-ene
CID 12540868
(2E)-7-methylocta-2,6-dienoyl chloride
CID 14192462
(6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene;phosphoric acid
CID 174586289
(6E)-9-diethoxyphosphoryl-2,6-dimethylnona-2,6-diene
CID 11335218
5,9,13-trimethyltetradeca-4,8,12-trienoyl chloride
CID 54440908
triazanium;[(3E)-4,8-dimethylnona-3,7-dienyl]-phosphonatooxyphosphinate
CID 11222230
3,7,11-trimethyldodeca-2,6,10-trienoyl chloride
CID 57199796
[hydroxy(4,8,12-trimethyltrideca-3,7,11-trienyl)phosphoryl]oxy-methoxy-oxophosphanium
CID 57261758
2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene;phosphono dihydrogen phosphate
CID 173057958
2-bromo-6-methylhepta-1,5-diene
CID 12000295
6-methoxy-2-methylhex-2-ene
CID 59087760
5-methyl-2-oxohex-4-enoyl chloride
CID 139842027

Frequently Asked Questions

What is the IUPAC name of 5-dichlorophosphoryl-2-methylpent-2-ene?
The IUPAC name of 5-dichlorophosphoryl-2-methylpent-2-ene (CID 171108038) is 5-dichlorophosphoryl-2-methylpent-2-ene.
What is the SMILES notation for 5-dichlorophosphoryl-2-methylpent-2-ene?
The canonical SMILES for 5-dichlorophosphoryl-2-methylpent-2-ene is CC(C)=CCCP(=O)(Cl)Cl.
What is the InChIKey of 5-dichlorophosphoryl-2-methylpent-2-ene?
The InChIKey is UCLYEUTWBJAYBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11Cl2OP/c1-6(2)4-3-5-10(7,8)9/h4H,3,5H2,1-2H3.
What are the key properties of 5-dichlorophosphoryl-2-methylpent-2-ene?
5-dichlorophosphoryl-2-methylpent-2-ene has a molecular weight of 201.03 g/mol, XLogP of 4.01, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-dichlorophosphoryl-2-methylpent-2-ene is sourced from PubChem (CID 171108038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).