5-methylidenedodecan-6-yloxy-tri(propan-2-yl)silane

C22H46OSi — CID 102173275

IUPAC5-methylidenedodecan-6-yloxy-tri(propan-2-yl)silane
SMILESC=C(CCCC)C(CCCCCC)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C22H46OSi/c1-10-12-14-15-17-22(21(9)16-13-11-2)23-24(18(3)4,19(5)6)20(7)8/h18-20,22H,9-17H2,1-8H3
InChIKeySONAKFBOOSMGKL-UHFFFAOYSA-N
MW354.70 g/mol
LogP8.26
Rot. Bonds14

About 5-methylidenedodecan-6-yloxy-tri(propan-2-yl)silane

5-methylidenedodecan-6-yloxy-tri(propan-2-yl)silane (PubChem CID 102173275) has the molecular formula C22H46OSi and a molecular weight of 354.70 g/mol. Its IUPAC name is 5-methylidenedodecan-6-yloxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name5-methylidenedodecan-6-yloxy-tri(propan-2-yl)silane
PubChem CID102173275
Molecular FormulaC22H46OSi
Molecular Weight354.70 g/mol
Exact Mass354.33
IUPAC Name5-methylidenedodecan-6-yloxy-tri(propan-2-yl)silane
SMILESC=C(CCCC)C(CCCCCC)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C22H46OSi/c1-10-12-14-15-17-22(21(9)16-13-11-2)23-24(18(3)4,19(5)6)20(7)8/h18-20,22H,9-17H2,1-8H3
InChIKeySONAKFBOOSMGKL-UHFFFAOYSA-N
XLogP8.26
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.70
LogP ≤ 58.26
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

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CID 10869380
1-Nonen-3-ol, tert-butyldimethylsilyl ether
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CID 10265922
Tert-butyl-(4,4-difluorodec-1-en-3-yloxy)-dimethylsilane
CID 140988825
trans-3-tert-Butyldimethylsilyloxy-1-tributylstannyl-1-octene
CID 10414672
Tert-butyl-dimethyl-(1-tributylstannyloct-1-en-3-yloxy)silane
CID 72836218
tert-butyl-dimethyl-[(4R)-undec-1-en-4-yl]oxysilane
CID 10850655
tert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane
CID 16680055
12-Tridecen-2-yl trimethylsilyl ether
CID 100983019
Butoxy-dibutyl-(3-methylidenenonyl)silane
CID 101564536
tert-butyl-dimethyl-[(4R)-non-1-en-4-yl]oxysilane
CID 101808240
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CID 101937867

Frequently Asked Questions

What is the IUPAC name of 5-methylidenedodecan-6-yloxy-tri(propan-2-yl)silane?
The IUPAC name of 5-methylidenedodecan-6-yloxy-tri(propan-2-yl)silane (CID 102173275) is 5-methylidenedodecan-6-yloxy-tri(propan-2-yl)silane.
What is the SMILES notation for 5-methylidenedodecan-6-yloxy-tri(propan-2-yl)silane?
The canonical SMILES for 5-methylidenedodecan-6-yloxy-tri(propan-2-yl)silane is C=C(CCCC)C(CCCCCC)O[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of 5-methylidenedodecan-6-yloxy-tri(propan-2-yl)silane?
The InChIKey is SONAKFBOOSMGKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H46OSi/c1-10-12-14-15-17-22(21(9)16-13-11-2)23-24(18(3)4,19(5)6)20(7)8/h18-20,22H,9-17H2,1-8H3.
What are the key properties of 5-methylidenedodecan-6-yloxy-tri(propan-2-yl)silane?
5-methylidenedodecan-6-yloxy-tri(propan-2-yl)silane has a molecular weight of 354.70 g/mol, XLogP of 8.26, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylidenedodecan-6-yloxy-tri(propan-2-yl)silane is sourced from PubChem (CID 102173275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).