trimethyl-[(Z,4R)-4-methyl-1-phenyl-5-phenylmethoxypent-2-en-2-yl]silane

C22H30OSi — CID 101162239

IUPACtrimethyl-[(Z,4R)-4-methyl-1-phenyl-5-phenylmethoxypent-2-en-2-yl]silane
SMILESC[C@H](/C=C(/Cc1ccccc1)[Si](C)(C)C)COCc1ccccc1
InChIInChI=1S/C22H30OSi/c1-19(17-23-18-21-13-9-6-10-14-21)15-22(24(2,3)4)16-20-11-7-5-8-12-20/h5-15,19H,16-18H2,1-4H3/b22-15-/t19-/m1/s1
InChIKeyOXZPZEMMVINNFJ-MLPWYGTASA-N
MW338.57 g/mol
LogP5.89
Rot. Bonds8

About trimethyl-[(Z,4R)-4-methyl-1-phenyl-5-phenylmethoxypent-2-en-2-yl]silane

trimethyl-[(Z,4R)-4-methyl-1-phenyl-5-phenylmethoxypent-2-en-2-yl]silane (PubChem CID 101162239) has the molecular formula C22H30OSi and a molecular weight of 338.57 g/mol. Its IUPAC name is trimethyl-[(Z,4R)-4-methyl-1-phenyl-5-phenylmethoxypent-2-en-2-yl]silane.

Molecular Properties

Compound Nametrimethyl-[(Z,4R)-4-methyl-1-phenyl-5-phenylmethoxypent-2-en-2-yl]silane
PubChem CID101162239
Molecular FormulaC22H30OSi
Molecular Weight338.57 g/mol
Exact Mass338.21
IUPAC Nametrimethyl-[(Z,4R)-4-methyl-1-phenyl-5-phenylmethoxypent-2-en-2-yl]silane
SMILESC[C@H](/C=C(/Cc1ccccc1)[Si](C)(C)C)COCc1ccccc1
InChIInChI=1S/C22H30OSi/c1-19(17-23-18-21-13-9-6-10-14-21)15-22(24(2,3)4)16-20-11-7-5-8-12-20/h5-15,19H,16-18H2,1-4H3/b22-15-/t19-/m1/s1
InChIKeyOXZPZEMMVINNFJ-MLPWYGTASA-N
XLogP5.89
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.57
LogP ≤ 55.89
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 trimethyl-[(Z,4R)-4-methyl-1-phenyl-5-phenylmethoxypent-2-en-2-yl]silane?
The IUPAC name of trimethyl-[(Z,4R)-4-methyl-1-phenyl-5-phenylmethoxypent-2-en-2-yl]silane (CID 101162239) is trimethyl-[(Z,4R)-4-methyl-1-phenyl-5-phenylmethoxypent-2-en-2-yl]silane.
What is the SMILES notation for trimethyl-[(Z,4R)-4-methyl-1-phenyl-5-phenylmethoxypent-2-en-2-yl]silane?
The canonical SMILES for trimethyl-[(Z,4R)-4-methyl-1-phenyl-5-phenylmethoxypent-2-en-2-yl]silane is C[C@H](/C=C(/Cc1ccccc1)[Si](C)(C)C)COCc1ccccc1.
What is the InChIKey of trimethyl-[(Z,4R)-4-methyl-1-phenyl-5-phenylmethoxypent-2-en-2-yl]silane?
The InChIKey is OXZPZEMMVINNFJ-MLPWYGTASA-N. The full InChI is InChI=1S/C22H30OSi/c1-19(17-23-18-21-13-9-6-10-14-21)15-22(24(2,3)4)16-20-11-7-5-8-12-20/h5-15,19H,16-18H2,1-4H3/b22-15-/t19-/m1/s1.
What are the key properties of trimethyl-[(Z,4R)-4-methyl-1-phenyl-5-phenylmethoxypent-2-en-2-yl]silane?
trimethyl-[(Z,4R)-4-methyl-1-phenyl-5-phenylmethoxypent-2-en-2-yl]silane has a molecular weight of 338.57 g/mol, XLogP of 5.89, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(Z,4R)-4-methyl-1-phenyl-5-phenylmethoxypent-2-en-2-yl]silane is sourced from PubChem (CID 101162239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).