dimethyl-octadecyl-prop-2-enoxysilane

C23H48OSi — CID 86033476

IUPACdimethyl-octadecyl-prop-2-enoxysilane
SMILESC=CCO[Si](C)(C)CCCCCCCCCCCCCCCCCC
InChIInChI=1S/C23H48OSi/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-25(3,4)24-22-6-2/h6H,2,5,7-23H2,1,3-4H3
InChIKeyXVPOYYSAGPVLAR-UHFFFAOYSA-N
MW368.72 g/mol
LogP8.66
Rot. Bonds20

About dimethyl-octadecyl-prop-2-enoxysilane

dimethyl-octadecyl-prop-2-enoxysilane (PubChem CID 86033476) has the molecular formula C23H48OSi and a molecular weight of 368.72 g/mol. Its IUPAC name is dimethyl-octadecyl-prop-2-enoxysilane.

Molecular Properties

Compound Namedimethyl-octadecyl-prop-2-enoxysilane
PubChem CID86033476
Molecular FormulaC23H48OSi
Molecular Weight368.72 g/mol
Exact Mass368.35
IUPAC Namedimethyl-octadecyl-prop-2-enoxysilane
SMILESC=CCO[Si](C)(C)CCCCCCCCCCCCCCCCCC
InChIInChI=1S/C23H48OSi/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-25(3,4)24-22-6-2/h6H,2,5,7-23H2,1,3-4H3
InChIKeyXVPOYYSAGPVLAR-UHFFFAOYSA-N
XLogP8.66
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds20
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.72
LogP ≤ 58.66
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': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

tert-butyl-[(E)-dec-1-enoxy]-dimethylsilane
CID 11065530
1-Dimethyldodecylsilyloxy-3-methylbut-2-ene
CID 531344
1-Dimethyldodecylsilyloxypent-2-en-4-yne
CID 531345
3-Dimethyl(octyl)silyloxy-1-propene
CID 575437
tert-butyl-dimethyl-[(E)-undec-1-enoxy]silane
CID 14942039
tert-butyl-[(Z)-dec-1-enoxy]-dimethylsilane
CID 101698294
1-(Dimethyl(prop-2-enyl)silyloxy)dodecane
CID 554874
1-Dimethyl(prop-2-enyl)silyloxytridecane
CID 554891
Allyl(dimethyl)silyl octadecyl ether
CID 554933
3-Tributylsilyloxypropene
CID 588594
Allyldimethylsilyl tetradecyl ether
CID 623242
Allyldimethylsilyl hexadecyl ether
CID 626998

Frequently Asked Questions

What is the IUPAC name of dimethyl-octadecyl-prop-2-enoxysilane?
The IUPAC name of dimethyl-octadecyl-prop-2-enoxysilane (CID 86033476) is dimethyl-octadecyl-prop-2-enoxysilane.
What is the SMILES notation for dimethyl-octadecyl-prop-2-enoxysilane?
The canonical SMILES for dimethyl-octadecyl-prop-2-enoxysilane is C=CCO[Si](C)(C)CCCCCCCCCCCCCCCCCC.
What is the InChIKey of dimethyl-octadecyl-prop-2-enoxysilane?
The InChIKey is XVPOYYSAGPVLAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H48OSi/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-25(3,4)24-22-6-2/h6H,2,5,7-23H2,1,3-4H3.
What are the key properties of dimethyl-octadecyl-prop-2-enoxysilane?
dimethyl-octadecyl-prop-2-enoxysilane has a molecular weight of 368.72 g/mol, XLogP of 8.66, 20 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-octadecyl-prop-2-enoxysilane is sourced from PubChem (CID 86033476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).