[(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane

C21H30O3Si2 — CID 173039666

IUPAC[(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane
SMILESCO[Si](OC)(OC)C(C)/C=C/c1ccccc1.[SiH3]/C=C/c1ccccc1
InChIInChI=1S/C13H20O3Si.C8H10Si/c1-12(17(14-2,15-3)16-4)10-11-13-8-6-5-7-9-13;9-7-6-8-4-2-1-3-5-8/h5-12H,1-4H3;1-7H,9H3/b11-10+;7-6+
InChIKeyHXHGDZQRWLSIJE-REAZOKNCSA-N
MW386.64 g/mol
LogP3.99
Rot. Bonds7

About [(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane

[(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane (PubChem CID 173039666) has the molecular formula C21H30O3Si2 and a molecular weight of 386.64 g/mol. Its IUPAC name is [(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane.

Molecular Properties

Compound Name[(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane
PubChem CID173039666
Molecular FormulaC21H30O3Si2
Molecular Weight386.64 g/mol
Exact Mass386.17
IUPAC Name[(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane
SMILESCO[Si](OC)(OC)C(C)/C=C/c1ccccc1.[SiH3]/C=C/c1ccccc1
InChIInChI=1S/C13H20O3Si.C8H10Si/c1-12(17(14-2,15-3)16-4)10-11-13-8-6-5-7-9-13;9-7-6-8-4-2-1-3-5-8/h5-12H,1-4H3;1-7H,9H3/b11-10+;7-6+
InChIKeyHXHGDZQRWLSIJE-REAZOKNCSA-N
XLogP3.99
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.64
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze [(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane 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

[(Z,3S,4R)-4-methoxy-3-methylpent-1-enyl]benzene
CID 102252703
trimethyl(2-phenylethenyl)phosphanium
CID 69015838
(Z,2R)-4-phenylbut-3-en-2-ol
CID 11457765
(3-bromo-3-methoxyprop-1-enyl)benzene
CID 118936577
[(E)-4,4-difluoro-3-methylbut-1-enyl]benzene
CID 132509961
[(E)-1-methoxy-3-phenylprop-2-enyl]benzene
CID 10353588
(E,3R,4S)-5,5-dimethoxy-4-methyl-1-phenylpent-1-en-3-ol
CID 102022397
3-methoxypent-1-enylbenzene
CID 71364960
1-methyl-4-[(E,2R)-4-phenylbut-3-en-2-yl]benzene
CID 102584248
bromomethyl-dimethyl-[(E)-4-phenylbut-3-en-2-yl]oxysilane
CID 13272629
(E)-2-methoxy-4-phenylbut-3-enoic acid
CID 11217749
2-(4-phenylbut-3-en-2-yl)-1H-imidazole
CID 70565796

Frequently Asked Questions

What is the IUPAC name of [(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane?
The IUPAC name of [(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane (CID 173039666) is [(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane.
What is the SMILES notation for [(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane?
The canonical SMILES for [(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane is CO[Si](OC)(OC)C(C)/C=C/c1ccccc1.[SiH3]/C=C/c1ccccc1.
What is the InChIKey of [(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane?
The InChIKey is HXHGDZQRWLSIJE-REAZOKNCSA-N. The full InChI is InChI=1S/C13H20O3Si.C8H10Si/c1-12(17(14-2,15-3)16-4)10-11-13-8-6-5-7-9-13;9-7-6-8-4-2-1-3-5-8/h5-12H,1-4H3;1-7H,9H3/b11-10+;7-6+.
What are the key properties of [(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane?
[(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane has a molecular weight of 386.64 g/mol, XLogP of 3.99, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-2-phenylethenyl]silane;trimethoxy-[(E)-4-phenylbut-3-en-2-yl]silane is sourced from PubChem (CID 173039666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).