CID 177393997

C13H25OSi3 — CID 177393997

IUPAC—
SMILESCOc1ccc([Si](C)(C)[Si](C)(C)[Si](C)C)cc1
InChIInChI=1S/C13H25OSi3/c1-14-12-8-10-13(11-9-12)16(4,5)17(6,7)15(2)3/h8-11H,1-7H3
InChIKeyWJUGKYXPEGESBH-UHFFFAOYSA-N
MW281.60 g/mol
LogP3.23
Rot. Bonds4

About CID 177393997

CID 177393997 (PubChem CID 177393997) has the molecular formula C13H25OSi3 and a molecular weight of 281.60 g/mol.

Molecular Properties

Compound NameCID 177393997
PubChem CID177393997
Molecular FormulaC13H25OSi3
Molecular Weight281.60 g/mol
Exact Mass281.12
IUPAC Name—
SMILESCOc1ccc([Si](C)(C)[Si](C)(C)[Si](C)C)cc1
InChIInChI=1S/C13H25OSi3/c1-14-12-8-10-13(11-9-12)16(4,5)17(6,7)15(2)3/h8-11H,1-7H3
InChIKeyWJUGKYXPEGESBH-UHFFFAOYSA-N
XLogP3.23
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.60
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

dichloro-bis(4-methoxyphenyl)silane
CID 15847326
trichloro-(4-methoxyphenyl)silane
CID 13219757
2-[(4-methoxyphenyl)-dimethylsilyl]ethanol
CID 11052925
1,4-dimethoxybenzene;molecular nitrogen;hydrochloride
CID 173452430
ethyl 2-[(4-methoxyphenyl)-dimethylsilyl]acetate
CID 11075965
tetramethyl (1Z,3E)-1,4-bis[(4-methoxyphenyl)-dimethylsilyl]buta-1,3-diene-1,2,3,4-tetracarboxylate
CID 177491638
CID 177452174
CID 177452174
1-(113C)methoxy-4-methylbenzene
CID 166176950
[(4-Methoxyphenyl)methyl]di(methyl)silane
CID 6330287
(4-methoxyphenyl)(113C)methyl-trimethylsilane
CID 101034579
(4-methoxybenzoyl)-λ2-stannane
CID 174742034
dichloro-cyclohexyl-(4-methoxyphenyl)silane
CID 15514740

Frequently Asked Questions

What is the IUPAC name of CID 177393997?
The IUPAC name of CID 177393997 (CID 177393997) is not available.
What is the SMILES notation for CID 177393997?
The canonical SMILES for CID 177393997 is COc1ccc([Si](C)(C)[Si](C)(C)[Si](C)C)cc1.
What is the InChIKey of CID 177393997?
The InChIKey is WJUGKYXPEGESBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25OSi3/c1-14-12-8-10-13(11-9-12)16(4,5)17(6,7)15(2)3/h8-11H,1-7H3.
What are the key properties of CID 177393997?
CID 177393997 has a molecular weight of 281.60 g/mol, XLogP of 3.23, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 177393997 is sourced from PubChem (CID 177393997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).