chloromethyl-dimethyl-undec-10-enoxysilane

C14H29ClOSi — CID 554275

IUPACchloromethyl-dimethyl-undec-10-enoxysilane
SMILESC=CCCCCCCCCCO[Si](C)(C)CCl
InChIInChI=1S/C14H29ClOSi/c1-4-5-6-7-8-9-10-11-12-13-16-17(2,3)14-15/h4H,1,5-14H2,2-3H3
InChIKeyIXBSSXUNQBTNSN-UHFFFAOYSA-N
MW276.92 g/mol
LogP5.29
Rot. Bonds12

About chloromethyl-dimethyl-undec-10-enoxysilane

chloromethyl-dimethyl-undec-10-enoxysilane (PubChem CID 554275) has the molecular formula C14H29ClOSi and a molecular weight of 276.92 g/mol. Its IUPAC name is chloromethyl-dimethyl-undec-10-enoxysilane.

Molecular Properties

Compound Namechloromethyl-dimethyl-undec-10-enoxysilane
PubChem CID554275
Molecular FormulaC14H29ClOSi
Molecular Weight276.92 g/mol
Exact Mass276.17
IUPAC Namechloromethyl-dimethyl-undec-10-enoxysilane
SMILESC=CCCCCCCCCCO[Si](C)(C)CCl
InChIInChI=1S/C14H29ClOSi/c1-4-5-6-7-8-9-10-11-12-13-16-17(2,3)14-15/h4H,1,5-14H2,2-3H3
InChIKeyIXBSSXUNQBTNSN-UHFFFAOYSA-N
XLogP5.29
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.92
LogP ≤ 55.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

chloromethyl-dimethyl-tetradecoxysilane
CID 554899
tert-butyl-dimethyl-octadec-17-enoxysilane
CID 24879926
trimethyl oct-7-enyl silicate
CID 154097389
tetrakis(hex-5-enyl) silicate
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but-3-enoxy-dimethyl-nonoxysilane
CID 91736688
hept-6-enoxysilyloxy(trimethyl)silane
CID 123996335
12-dodec-11-enoxydodec-1-ene
CID 87325659
11-[3-[10-(3-chloropropoxy)decoxy]propoxy]undec-1-ene
CID 142736704
heptacosa-1,26-diene
CID 58905535
heptadeca-1,16-diene
CID 6429392
ethoxy-hex-5-enyl-dimethylsilane
CID 87088698
but-3-enoxy-[dimethyl(tridecoxy)silyl]oxy-dimethylsilane
CID 91742954

Frequently Asked Questions

What is the IUPAC name of chloromethyl-dimethyl-undec-10-enoxysilane?
The IUPAC name of chloromethyl-dimethyl-undec-10-enoxysilane (CID 554275) is chloromethyl-dimethyl-undec-10-enoxysilane.
What is the SMILES notation for chloromethyl-dimethyl-undec-10-enoxysilane?
The canonical SMILES for chloromethyl-dimethyl-undec-10-enoxysilane is C=CCCCCCCCCCO[Si](C)(C)CCl.
What is the InChIKey of chloromethyl-dimethyl-undec-10-enoxysilane?
The InChIKey is IXBSSXUNQBTNSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29ClOSi/c1-4-5-6-7-8-9-10-11-12-13-16-17(2,3)14-15/h4H,1,5-14H2,2-3H3.
What are the key properties of chloromethyl-dimethyl-undec-10-enoxysilane?
chloromethyl-dimethyl-undec-10-enoxysilane has a molecular weight of 276.92 g/mol, XLogP of 5.29, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloromethyl-dimethyl-undec-10-enoxysilane is sourced from PubChem (CID 554275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).