tert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane

C14H30OSi — CID 11096807

IUPACtert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane
SMILESC=C[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](C)CCC
InChIInChI=1S/C14H30OSi/c1-9-11-12(3)13(10-2)15-16(7,8)14(4,5)6/h10,12-13H,2,9,11H2,1,3-8H3/t12-,13-/m0/s1
InChIKeyAKGRHIKXHCHKSS-STQMWFEESA-N
MW242.48 g/mol
LogP5.00
Rot. Bonds6

About tert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane

tert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane (PubChem CID 11096807) has the molecular formula C14H30OSi and a molecular weight of 242.48 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane
PubChem CID11096807
Molecular FormulaC14H30OSi
Molecular Weight242.48 g/mol
Exact Mass242.21
IUPAC Nametert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane
SMILESC=C[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](C)CCC
InChIInChI=1S/C14H30OSi/c1-9-11-12(3)13(10-2)15-16(7,8)14(4,5)6/h10,12-13H,2,9,11H2,1,3-8H3/t12-,13-/m0/s1
InChIKeyAKGRHIKXHCHKSS-STQMWFEESA-N
XLogP5.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.48
LogP ≤ 55.00
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'}

Analyze tert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Silane, (1,1-dimethylethyl)[(1-ethenylhexyl)oxy]dimethyl-
CID 9986037
Silane, (1,1-dimethylethyl)(1-ethenylbutoxy)dimethyl-
CID 11206678
tert-Butyldimethyl (1-methylhex-5-enyloxy)silane
CID 11241664
tert-butyl-dimethyl-[(1S,6S)-6-prop-2-enylcyclohex-3-en-1-yl]oxysilane
CID 11543369
Tert-butyl-(1-cyclopent-3-en-1-ylbut-3-enoxy)-dimethylsilane
CID 11666003
tert-butyl-dimethyl-[(1S,6R)-6-prop-2-enylcyclohex-3-en-1-yl]oxysilane
CID 134979966
(3R,4S,5R)-2,2-ditert-butyl-3,4-dimethyl-5-prop-2-enyloxasilolane
CID 391575
6-(Fluoromethyl)oct-1-en-4-yloxy-trimethylsilane
CID 140333677
5-Allyl-2,2-ditert-butyl-3,4-dimethyl-oxasilolane
CID 496488
Silane, dimethyl(pent-4-en-2-yloxy)isohexyloxy-
CID 91698385
1,2,3,6-Tetrahydrobenzylalcohol, tert-butyldimethylsilyl ether
CID 11229886
Tert-butyl-(1-cyclohexylprop-2-enoxy)-dimethylsilane
CID 11253834

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane (CID 11096807) is tert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane is C=C[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](C)CCC.
What is the InChIKey of tert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane?
The InChIKey is AKGRHIKXHCHKSS-STQMWFEESA-N. The full InChI is InChI=1S/C14H30OSi/c1-9-11-12(3)13(10-2)15-16(7,8)14(4,5)6/h10,12-13H,2,9,11H2,1,3-8H3/t12-,13-/m0/s1.
What are the key properties of tert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane?
tert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane has a molecular weight of 242.48 g/mol, XLogP of 5.00, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(3S,4S)-4-methylhept-1-en-3-yl]oxysilane is sourced from PubChem (CID 11096807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).