[(E,3R,4S)-4-methylnon-7-en-3-yl]oxy-tri(propan-2-yl)silane

C19H40OSi — CID 59558906

IUPAC[(E,3R,4S)-4-methylnon-7-en-3-yl]oxy-tri(propan-2-yl)silane
SMILESC/C=C/CC[C@H](C)[C@@H](CC)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C19H40OSi/c1-10-12-13-14-18(9)19(11-2)20-21(15(3)4,16(5)6)17(7)8/h10,12,15-19H,11,13-14H2,1-9H3/b12-10+/t18-,19+/m0/s1
InChIKeyPMLCXAQUWOPQNJ-GMIBQGTOSA-N
MW312.61 g/mol
LogP6.95
Rot. Bonds10

About [(E,3R,4S)-4-methylnon-7-en-3-yl]oxy-tri(propan-2-yl)silane

[(E,3R,4S)-4-methylnon-7-en-3-yl]oxy-tri(propan-2-yl)silane (PubChem CID 59558906) has the molecular formula C19H40OSi and a molecular weight of 312.61 g/mol. Its IUPAC name is [(E,3R,4S)-4-methylnon-7-en-3-yl]oxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[(E,3R,4S)-4-methylnon-7-en-3-yl]oxy-tri(propan-2-yl)silane
PubChem CID59558906
Molecular FormulaC19H40OSi
Molecular Weight312.61 g/mol
Exact Mass312.28
IUPAC Name[(E,3R,4S)-4-methylnon-7-en-3-yl]oxy-tri(propan-2-yl)silane
SMILESC/C=C/CC[C@H](C)[C@@H](CC)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C19H40OSi/c1-10-12-13-14-18(9)19(11-2)20-21(15(3)4,16(5)6)17(7)8/h10,12,15-19H,11,13-14H2,1-9H3/b12-10+/t18-,19+/m0/s1
InChIKeyPMLCXAQUWOPQNJ-GMIBQGTOSA-N
XLogP6.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.61
LogP ≤ 56.95
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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Frequently Asked Questions

What is the IUPAC name of [(E,3R,4S)-4-methylnon-7-en-3-yl]oxy-tri(propan-2-yl)silane?
The IUPAC name of [(E,3R,4S)-4-methylnon-7-en-3-yl]oxy-tri(propan-2-yl)silane (CID 59558906) is [(E,3R,4S)-4-methylnon-7-en-3-yl]oxy-tri(propan-2-yl)silane.
What is the SMILES notation for [(E,3R,4S)-4-methylnon-7-en-3-yl]oxy-tri(propan-2-yl)silane?
The canonical SMILES for [(E,3R,4S)-4-methylnon-7-en-3-yl]oxy-tri(propan-2-yl)silane is C/C=C/CC[C@H](C)[C@@H](CC)O[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of [(E,3R,4S)-4-methylnon-7-en-3-yl]oxy-tri(propan-2-yl)silane?
The InChIKey is PMLCXAQUWOPQNJ-GMIBQGTOSA-N. The full InChI is InChI=1S/C19H40OSi/c1-10-12-13-14-18(9)19(11-2)20-21(15(3)4,16(5)6)17(7)8/h10,12,15-19H,11,13-14H2,1-9H3/b12-10+/t18-,19+/m0/s1.
What are the key properties of [(E,3R,4S)-4-methylnon-7-en-3-yl]oxy-tri(propan-2-yl)silane?
[(E,3R,4S)-4-methylnon-7-en-3-yl]oxy-tri(propan-2-yl)silane has a molecular weight of 312.61 g/mol, XLogP of 6.95, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E,3R,4S)-4-methylnon-7-en-3-yl]oxy-tri(propan-2-yl)silane is sourced from PubChem (CID 59558906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).