[(Z,5R,6S)-6-methoxy-2,2,5-trimethylhept-3-en-4-yl]-trimethylsilane

C14H30OSi — CID 102252704

IUPAC[(Z,5R,6S)-6-methoxy-2,2,5-trimethylhept-3-en-4-yl]-trimethylsilane
SMILESCO[C@@H](C)[C@@H](C)/C(=C/C(C)(C)C)[Si](C)(C)C
InChIInChI=1S/C14H30OSi/c1-11(12(2)15-6)13(16(7,8)9)10-14(3,4)5/h10-12H,1-9H3/b13-10-/t11-,12+/m1/s1
InChIKeyNJILCFXZPPXMTM-SZKSSMSYSA-N
MW242.48 g/mol
LogP4.51
Rot. Bonds4

About [(Z,5R,6S)-6-methoxy-2,2,5-trimethylhept-3-en-4-yl]-trimethylsilane

[(Z,5R,6S)-6-methoxy-2,2,5-trimethylhept-3-en-4-yl]-trimethylsilane (PubChem CID 102252704) has the molecular formula C14H30OSi and a molecular weight of 242.48 g/mol. Its IUPAC name is [(Z,5R,6S)-6-methoxy-2,2,5-trimethylhept-3-en-4-yl]-trimethylsilane.

Molecular Properties

Compound Name[(Z,5R,6S)-6-methoxy-2,2,5-trimethylhept-3-en-4-yl]-trimethylsilane
PubChem CID102252704
Molecular FormulaC14H30OSi
Molecular Weight242.48 g/mol
Exact Mass242.21
IUPAC Name[(Z,5R,6S)-6-methoxy-2,2,5-trimethylhept-3-en-4-yl]-trimethylsilane
SMILESCO[C@@H](C)[C@@H](C)/C(=C/C(C)(C)C)[Si](C)(C)C
InChIInChI=1S/C14H30OSi/c1-11(12(2)15-6)13(16(7,8)9)10-14(3,4)5/h10-12H,1-9H3/b13-10-/t11-,12+/m1/s1
InChIKeyNJILCFXZPPXMTM-SZKSSMSYSA-N
XLogP4.51
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.48
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(Z,5R,6S)-6-methoxy-2,2,5-trimethylhept-3-en-4-yl]-trimethylsilane?
The IUPAC name of [(Z,5R,6S)-6-methoxy-2,2,5-trimethylhept-3-en-4-yl]-trimethylsilane (CID 102252704) is [(Z,5R,6S)-6-methoxy-2,2,5-trimethylhept-3-en-4-yl]-trimethylsilane.
What is the SMILES notation for [(Z,5R,6S)-6-methoxy-2,2,5-trimethylhept-3-en-4-yl]-trimethylsilane?
The canonical SMILES for [(Z,5R,6S)-6-methoxy-2,2,5-trimethylhept-3-en-4-yl]-trimethylsilane is CO[C@@H](C)[C@@H](C)/C(=C/C(C)(C)C)[Si](C)(C)C.
What is the InChIKey of [(Z,5R,6S)-6-methoxy-2,2,5-trimethylhept-3-en-4-yl]-trimethylsilane?
The InChIKey is NJILCFXZPPXMTM-SZKSSMSYSA-N. The full InChI is InChI=1S/C14H30OSi/c1-11(12(2)15-6)13(16(7,8)9)10-14(3,4)5/h10-12H,1-9H3/b13-10-/t11-,12+/m1/s1.
What are the key properties of [(Z,5R,6S)-6-methoxy-2,2,5-trimethylhept-3-en-4-yl]-trimethylsilane?
[(Z,5R,6S)-6-methoxy-2,2,5-trimethylhept-3-en-4-yl]-trimethylsilane has a molecular weight of 242.48 g/mol, XLogP of 4.51, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z,5R,6S)-6-methoxy-2,2,5-trimethylhept-3-en-4-yl]-trimethylsilane is sourced from PubChem (CID 102252704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).