deca-1,5-diynoxy-tri(propan-2-yl)silane

C19H34OSi — CID 134875390

IUPACdeca-1,5-diynoxy-tri(propan-2-yl)silane
SMILESCCCCC#CCCC#CO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C19H34OSi/c1-8-9-10-11-12-13-14-15-16-20-21(17(2)3,18(4)5)19(6)7/h17-19H,8-10,13-14H2,1-7H3
InChIKeyXTWIWPGPKQZTJC-UHFFFAOYSA-N
MW306.57 g/mol
LogP6.11
Rot. Bonds7

About deca-1,5-diynoxy-tri(propan-2-yl)silane

deca-1,5-diynoxy-tri(propan-2-yl)silane (PubChem CID 134875390) has the molecular formula C19H34OSi and a molecular weight of 306.57 g/mol. Its IUPAC name is deca-1,5-diynoxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Namedeca-1,5-diynoxy-tri(propan-2-yl)silane
PubChem CID134875390
Molecular FormulaC19H34OSi
Molecular Weight306.57 g/mol
Exact Mass306.24
IUPAC Namedeca-1,5-diynoxy-tri(propan-2-yl)silane
SMILESCCCCC#CCCC#CO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C19H34OSi/c1-8-9-10-11-12-13-14-15-16-20-21(17(2)3,18(4)5)19(6)7/h17-19H,8-10,13-14H2,1-7H3
InChIKeyXTWIWPGPKQZTJC-UHFFFAOYSA-N
XLogP6.11
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.57
LogP ≤ 56.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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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Frequently Asked Questions

What is the IUPAC name of deca-1,5-diynoxy-tri(propan-2-yl)silane?
The IUPAC name of deca-1,5-diynoxy-tri(propan-2-yl)silane (CID 134875390) is deca-1,5-diynoxy-tri(propan-2-yl)silane.
What is the SMILES notation for deca-1,5-diynoxy-tri(propan-2-yl)silane?
The canonical SMILES for deca-1,5-diynoxy-tri(propan-2-yl)silane is CCCCC#CCCC#CO[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of deca-1,5-diynoxy-tri(propan-2-yl)silane?
The InChIKey is XTWIWPGPKQZTJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34OSi/c1-8-9-10-11-12-13-14-15-16-20-21(17(2)3,18(4)5)19(6)7/h17-19H,8-10,13-14H2,1-7H3.
What are the key properties of deca-1,5-diynoxy-tri(propan-2-yl)silane?
deca-1,5-diynoxy-tri(propan-2-yl)silane has a molecular weight of 306.57 g/mol, XLogP of 6.11, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for deca-1,5-diynoxy-tri(propan-2-yl)silane is sourced from PubChem (CID 134875390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).