3-methylidenedec-1-ynyl-tri(propan-2-yl)silane

C20H38Si — CID 102322020

IUPAC3-methylidenedec-1-ynyl-tri(propan-2-yl)silane
SMILESC=C(C#C[Si](C(C)C)(C(C)C)C(C)C)CCCCCCC
InChIInChI=1S/C20H38Si/c1-9-10-11-12-13-14-20(8)15-16-21(17(2)3,18(4)5)19(6)7/h17-19H,8-14H2,1-7H3
InChIKeyKSEDAPWFJRGPLR-UHFFFAOYSA-N
MW306.61 g/mol
LogP7.12
Rot. Bonds9

About 3-methylidenedec-1-ynyl-tri(propan-2-yl)silane

3-methylidenedec-1-ynyl-tri(propan-2-yl)silane (PubChem CID 102322020) has the molecular formula C20H38Si and a molecular weight of 306.61 g/mol. Its IUPAC name is 3-methylidenedec-1-ynyl-tri(propan-2-yl)silane.

Molecular Properties

Compound Name3-methylidenedec-1-ynyl-tri(propan-2-yl)silane
PubChem CID102322020
Molecular FormulaC20H38Si
Molecular Weight306.61 g/mol
Exact Mass306.27
IUPAC Name3-methylidenedec-1-ynyl-tri(propan-2-yl)silane
SMILESC=C(C#C[Si](C(C)C)(C(C)C)C(C)C)CCCCCCC
InChIInChI=1S/C20H38Si/c1-9-10-11-12-13-14-20(8)15-16-21(17(2)3,18(4)5)19(6)7/h17-19H,8-14H2,1-7H3
InChIKeyKSEDAPWFJRGPLR-UHFFFAOYSA-N
XLogP7.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.61
LogP ≤ 57.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

trimethyl-[(E)-2-methyloct-1-enyl]silane
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[(E)-2-ethyloct-1-enyl]-trimethylsilane
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Triisopropyl(3-methylenenon-1-yn-1-yl)silane
CID 102088940
Trimethyl(3-methylidenenonyl)silane
CID 10584673
3-Butylocta-1,2-dien-7-ynyl(trimethyl)silane
CID 10704881
Hexadeca-6,7-dien-1-ynyl(trimethyl)silane
CID 11109061
Trimethyl(pentadeca-6,7-dien-1-ynyl)silane
CID 11780808
trimethyl-[(Z)-2-methyloct-1-enyl]silane
CID 12426804
[(Z)-2-ethyloct-1-enyl]-trimethylsilane
CID 12458688
Trimethyl(6-methylhept-6-en-1-yn-1-yl)silane
CID 13759055
Trimethyl(2-methylidenenonyl)silane
CID 13979642
3,4-Dihexyl-1,1-dimethylsilole
CID 14960758

Frequently Asked Questions

What is the IUPAC name of 3-methylidenedec-1-ynyl-tri(propan-2-yl)silane?
The IUPAC name of 3-methylidenedec-1-ynyl-tri(propan-2-yl)silane (CID 102322020) is 3-methylidenedec-1-ynyl-tri(propan-2-yl)silane.
What is the SMILES notation for 3-methylidenedec-1-ynyl-tri(propan-2-yl)silane?
The canonical SMILES for 3-methylidenedec-1-ynyl-tri(propan-2-yl)silane is C=C(C#C[Si](C(C)C)(C(C)C)C(C)C)CCCCCCC.
What is the InChIKey of 3-methylidenedec-1-ynyl-tri(propan-2-yl)silane?
The InChIKey is KSEDAPWFJRGPLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H38Si/c1-9-10-11-12-13-14-20(8)15-16-21(17(2)3,18(4)5)19(6)7/h17-19H,8-14H2,1-7H3.
What are the key properties of 3-methylidenedec-1-ynyl-tri(propan-2-yl)silane?
3-methylidenedec-1-ynyl-tri(propan-2-yl)silane has a molecular weight of 306.61 g/mol, XLogP of 7.12, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylidenedec-1-ynyl-tri(propan-2-yl)silane is sourced from PubChem (CID 102322020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).