CID 66773183

C14H20O2Si — CID 66773183

IUPAC—
SMILESCCCc1cccc([Si]OC(C)=O)c1CCC
InChIInChI=1S/C14H20O2Si/c1-4-7-12-9-6-10-14(13(12)8-5-2)17-16-11(3)15/h6,9-10H,4-5,7-8H2,1-3H3
InChIKeyFIBCRMXGWDHYBR-UHFFFAOYSA-N
MW248.40 g/mol
LogP2.40
Rot. Bonds6

About CID 66773183

CID 66773183 (PubChem CID 66773183) has the molecular formula C14H20O2Si and a molecular weight of 248.40 g/mol.

Molecular Properties

Compound NameCID 66773183
PubChem CID66773183
Molecular FormulaC14H20O2Si
Molecular Weight248.40 g/mol
Exact Mass248.12
IUPAC Name—
SMILESCCCc1cccc([Si]OC(C)=O)c1CCC
InChIInChI=1S/C14H20O2Si/c1-4-7-12-9-6-10-14(13(12)8-5-2)17-16-11(3)15/h6,9-10H,4-5,7-8H2,1-3H3
InChIKeyFIBCRMXGWDHYBR-UHFFFAOYSA-N
XLogP2.40
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.40
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

CID 90259997
CID 90259997
(2-propylphenyl)methyl acetate
CID 18363688
1-[2-(hydroxymethyl)-6-propylphenyl]propan-2-one
CID 70506977
(2-methoxy-6-propylphenyl) acetate
CID 170893292
2-[2-(2,3-dipropylphenoxy)phenyl]acetic acid
CID 21113142
1-(2,3-dipropylphenyl)-2-hydroxy-2-methylpropan-1-one
CID 175493914
(2,3-dipropylphenyl)-phenylmethanone
CID 23045952
[2-(hydroxymethyl)-3-propylphenyl]methanol
CID 118644202
(2,3-dipropylphenyl)-methoxyphosphinic acid
CID 87674891
zinc bis(N-[(2,3-dipropylphenyl)disulfanyl]carbamate)
CID 87878446
[2,3-dibutyl-4-(2,3-dipropylphenyl)phenyl] hydrogen carbonate
CID 67179302
CID 160937062
CID 160937062

Frequently Asked Questions

What is the IUPAC name of CID 66773183?
The IUPAC name of CID 66773183 (CID 66773183) is not available.
What is the SMILES notation for CID 66773183?
The canonical SMILES for CID 66773183 is CCCc1cccc([Si]OC(C)=O)c1CCC.
What is the InChIKey of CID 66773183?
The InChIKey is FIBCRMXGWDHYBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O2Si/c1-4-7-12-9-6-10-14(13(12)8-5-2)17-16-11(3)15/h6,9-10H,4-5,7-8H2,1-3H3.
What are the key properties of CID 66773183?
CID 66773183 has a molecular weight of 248.40 g/mol, XLogP of 2.40, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 66773183 is sourced from PubChem (CID 66773183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).