[1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane

C12H22Cl2O2Si — CID 101483838

IUPAC[1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane
SMILESCC1(CCC(C=C(Cl)Cl)[Si](C)(C)C)OCCO1
InChIInChI=1S/C12H22Cl2O2Si/c1-12(15-7-8-16-12)6-5-10(9-11(13)14)17(2,3)4/h9-10H,5-8H2,1-4H3
InChIKeyYHFZYWBLKIPOOH-UHFFFAOYSA-N
MW297.30 g/mol
LogP4.56
Rot. Bonds5

About [1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane

[1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane (PubChem CID 101483838) has the molecular formula C12H22Cl2O2Si and a molecular weight of 297.30 g/mol. Its IUPAC name is [1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane.

Molecular Properties

Compound Name[1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane
PubChem CID101483838
Molecular FormulaC12H22Cl2O2Si
Molecular Weight297.30 g/mol
Exact Mass296.08
IUPAC Name[1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane
SMILESCC1(CCC(C=C(Cl)Cl)[Si](C)(C)C)OCCO1
InChIInChI=1S/C12H22Cl2O2Si/c1-12(15-7-8-16-12)6-5-10(9-11(13)14)17(2,3)4/h9-10H,5-8H2,1-4H3
InChIKeyYHFZYWBLKIPOOH-UHFFFAOYSA-N
XLogP4.56
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.30
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-2-(3-methylpentyl)-1,3-dioxolane
CID 13315713
2-methyl-6-(2-methyl-1,3-dioxolan-2-yl)hexan-3-ol
CID 14689313
1,1,2,2-tetradeuterio-3-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol
CID 46782226
5-(2-methyl-1,3-dioxolan-2-yl)pentan-2-one;2-methyl-4-(2-methyl-1,3-dioxolan-2-yl)butanal
CID 161106627
2-methyl-2-(3-methylbut-3-enyl)-1,3-dioxolane
CID 130120416
2-(4-chlorobutyl)-2-methyl-1,3-dioxolane
CID 10965102
2-but-3-enyl-2-methyl-1,3-dioxolane
CID 11768681
(E)-2-methyl-5-(2-methyl-1,3-dioxolan-2-yl)pent-2-en-1-ol
CID 10559466
2-methyl-2-propyl-1,3,6-trioxocane
CID 89306416
2-but-2-enyl-2-methyl-1,3-dioxolane
CID 162417486
4-[2-(2-methyl-1,3-dioxolan-2-yl)ethylamino]pentan-1-ol
CID 104628582
2-benzyl-4-(2-methyl-1,3-dioxolan-2-yl)butanal
CID 10243738

Frequently Asked Questions

What is the IUPAC name of [1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane?
The IUPAC name of [1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane (CID 101483838) is [1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane.
What is the SMILES notation for [1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane?
The canonical SMILES for [1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane is CC1(CCC(C=C(Cl)Cl)[Si](C)(C)C)OCCO1.
What is the InChIKey of [1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane?
The InChIKey is YHFZYWBLKIPOOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22Cl2O2Si/c1-12(15-7-8-16-12)6-5-10(9-11(13)14)17(2,3)4/h9-10H,5-8H2,1-4H3.
What are the key properties of [1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane?
[1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane has a molecular weight of 297.30 g/mol, XLogP of 4.56, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1,1-dichloro-5-(2-methyl-1,3-dioxolan-2-yl)pent-1-en-3-yl]-trimethylsilane is sourced from PubChem (CID 101483838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).