trimethyl-[[(1R,6S,7R)-6,7,9,9-tetramethyl-7-prop-2-enyl-2-bicyclo[4.2.1]non-2-enyl]oxy]silane

C19H34OSi — CID 10447896

IUPACtrimethyl-[[(1R,6S,7R)-6,7,9,9-tetramethyl-7-prop-2-enyl-2-bicyclo[4.2.1]non-2-enyl]oxy]silane
SMILESC=CC[C@]1(C)C[C@H]2C(O[Si](C)(C)C)=CCC[C@]1(C)C2(C)C
InChIInChI=1S/C19H34OSi/c1-9-12-18(4)14-15-16(20-21(6,7)8)11-10-13-19(18,5)17(15,2)3/h9,11,15H,1,10,12-14H2,2-8H3/t15-,18+,19+/m0/s1
InChIKeyDSCXVKOOVIVQGA-KFKAGJAMSA-N
MW306.57 g/mol
LogP6.15
Rot. Bonds4

About trimethyl-[[(1R,6S,7R)-6,7,9,9-tetramethyl-7-prop-2-enyl-2-bicyclo[4.2.1]non-2-enyl]oxy]silane

trimethyl-[[(1R,6S,7R)-6,7,9,9-tetramethyl-7-prop-2-enyl-2-bicyclo[4.2.1]non-2-enyl]oxy]silane (PubChem CID 10447896) has the molecular formula C19H34OSi and a molecular weight of 306.57 g/mol. Its IUPAC name is trimethyl-[[(1R,6S,7R)-6,7,9,9-tetramethyl-7-prop-2-enyl-2-bicyclo[4.2.1]non-2-enyl]oxy]silane.

Molecular Properties

Compound Nametrimethyl-[[(1R,6S,7R)-6,7,9,9-tetramethyl-7-prop-2-enyl-2-bicyclo[4.2.1]non-2-enyl]oxy]silane
PubChem CID10447896
Molecular FormulaC19H34OSi
Molecular Weight306.57 g/mol
Exact Mass306.24
IUPAC Nametrimethyl-[[(1R,6S,7R)-6,7,9,9-tetramethyl-7-prop-2-enyl-2-bicyclo[4.2.1]non-2-enyl]oxy]silane
SMILESC=CC[C@]1(C)C[C@H]2C(O[Si](C)(C)C)=CCC[C@]1(C)C2(C)C
InChIInChI=1S/C19H34OSi/c1-9-12-18(4)14-15-16(20-21(6,7)8)11-10-13-19(18,5)17(15,2)3/h9,11,15H,1,10,12-14H2,2-8H3/t15-,18+,19+/m0/s1
InChIKeyDSCXVKOOVIVQGA-KFKAGJAMSA-N
XLogP6.15
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.57
LogP ≤ 56.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Trimethyl[(1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-yl)oxy]silane
CID 12507206
Tert-butyl(dimethyl)silyl 1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-yl ether
CID 12495848
trimethyl-[[(1R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]hept-2-enyl]oxy]silane
CID 10036844
trimethyl-[[(1S,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]hept-2-enyl]oxy]silane
CID 11770112
trimethyl-[(3R,4R)-3-methyl-3-[2-[(1S)-1-methylcyclohex-2-en-1-yl]ethyl]-4-propan-2-ylcyclopenten-1-yl]oxysilane
CID 11984323
trimethyl-[[(1S,4S)-4,7,7-trimethyl-2-bicyclo[2.2.1]hept-2-enyl]oxy]silane
CID 134894231
[(3S,6S)-3-butyl-6-tert-butylcyclohexen-1-yl]oxy-trimethylsilane
CID 134922475
[(3R,6S)-3-butyl-6-tert-butylcyclohexen-1-yl]oxy-trimethylsilane
CID 134922490
[(3R,3aR,8aS)-3-ethenyl-5,5-dimethyl-1,2,3,4,6,8a-hexahydroazulen-3a-yl]oxy-tert-butyl-dimethylsilane
CID 134972665
CID 178270072
CID 178270072
rel-trimethyl[(3aR,4S,7R,7aR)-3a,4,7,7a-tetrahydro-1H-4,7-methanoinden-6-yloxy]silane
CID 639624
(3-Butyl-4,4-dimethylcyclohexen-1-yl)oxy-triethylsilane
CID 101998070

Frequently Asked Questions

What is the IUPAC name of trimethyl-[[(1R,6S,7R)-6,7,9,9-tetramethyl-7-prop-2-enyl-2-bicyclo[4.2.1]non-2-enyl]oxy]silane?
The IUPAC name of trimethyl-[[(1R,6S,7R)-6,7,9,9-tetramethyl-7-prop-2-enyl-2-bicyclo[4.2.1]non-2-enyl]oxy]silane (CID 10447896) is trimethyl-[[(1R,6S,7R)-6,7,9,9-tetramethyl-7-prop-2-enyl-2-bicyclo[4.2.1]non-2-enyl]oxy]silane.
What is the SMILES notation for trimethyl-[[(1R,6S,7R)-6,7,9,9-tetramethyl-7-prop-2-enyl-2-bicyclo[4.2.1]non-2-enyl]oxy]silane?
The canonical SMILES for trimethyl-[[(1R,6S,7R)-6,7,9,9-tetramethyl-7-prop-2-enyl-2-bicyclo[4.2.1]non-2-enyl]oxy]silane is C=CC[C@]1(C)C[C@H]2C(O[Si](C)(C)C)=CCC[C@]1(C)C2(C)C.
What is the InChIKey of trimethyl-[[(1R,6S,7R)-6,7,9,9-tetramethyl-7-prop-2-enyl-2-bicyclo[4.2.1]non-2-enyl]oxy]silane?
The InChIKey is DSCXVKOOVIVQGA-KFKAGJAMSA-N. The full InChI is InChI=1S/C19H34OSi/c1-9-12-18(4)14-15-16(20-21(6,7)8)11-10-13-19(18,5)17(15,2)3/h9,11,15H,1,10,12-14H2,2-8H3/t15-,18+,19+/m0/s1.
What are the key properties of trimethyl-[[(1R,6S,7R)-6,7,9,9-tetramethyl-7-prop-2-enyl-2-bicyclo[4.2.1]non-2-enyl]oxy]silane?
trimethyl-[[(1R,6S,7R)-6,7,9,9-tetramethyl-7-prop-2-enyl-2-bicyclo[4.2.1]non-2-enyl]oxy]silane has a molecular weight of 306.57 g/mol, XLogP of 6.15, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[[(1R,6S,7R)-6,7,9,9-tetramethyl-7-prop-2-enyl-2-bicyclo[4.2.1]non-2-enyl]oxy]silane is sourced from PubChem (CID 10447896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).