CID 140588184

C27H30Si — CID 140588184

IUPAC—
SMILESCCCCC1c2ccccc2-c2cc(C)c([Si]c3c(C)cc(C)cc3C)cc21
InChIInChI=1S/C27H30Si/c1-6-7-10-22-21-11-8-9-12-23(21)24-15-18(3)26(16-25(22)24)28-27-19(4)13-17(2)14-20(27)5/h8-9,11-16,22H,6-7,10H2,1-5H3
InChIKeyPERWZOJTOPANCS-UHFFFAOYSA-N
MW382.62 g/mol
LogP5.88
Rot. Bonds5

About CID 140588184

CID 140588184 (PubChem CID 140588184) has the molecular formula C27H30Si and a molecular weight of 382.62 g/mol.

Molecular Properties

Compound NameCID 140588184
PubChem CID140588184
Molecular FormulaC27H30Si
Molecular Weight382.62 g/mol
Exact Mass382.21
IUPAC Name—
SMILESCCCCC1c2ccccc2-c2cc(C)c([Si]c3c(C)cc(C)cc3C)cc21
InChIInChI=1S/C27H30Si/c1-6-7-10-22-21-11-8-9-12-23(21)24-15-18(3)26(16-25(22)24)28-27-19(4)13-17(2)14-20(27)5/h8-9,11-16,22H,6-7,10H2,1-5H3
InChIKeyPERWZOJTOPANCS-UHFFFAOYSA-N
XLogP5.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.62
LogP ≤ 55.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 140588742
2-(dibromomethyl)-9-octyl-9H-fluorene
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butyl-(3,5-dimethylphenyl)-(9H-fluoren-9-yl)-methylsilane
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CID 82579060
11-[2-(9H-fluoren-9-yl)ethyl]-11H-benzo[b]fluorene
CID 15494429
2,7-bis[6-(9H-fluoren-9-yl)hexoxy]-3,6,10,11-tetrapentoxytriphenylene
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9-[1-(9H-fluoren-9-yl)pentyl]-9H-fluorene
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9-butyl-2-(trifluoromethyl)-9H-thioxanthene
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Frequently Asked Questions

What is the IUPAC name of CID 140588184?
The IUPAC name of CID 140588184 (CID 140588184) is not available.
What is the SMILES notation for CID 140588184?
The canonical SMILES for CID 140588184 is CCCCC1c2ccccc2-c2cc(C)c([Si]c3c(C)cc(C)cc3C)cc21.
What is the InChIKey of CID 140588184?
The InChIKey is PERWZOJTOPANCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H30Si/c1-6-7-10-22-21-11-8-9-12-23(21)24-15-18(3)26(16-25(22)24)28-27-19(4)13-17(2)14-20(27)5/h8-9,11-16,22H,6-7,10H2,1-5H3.
What are the key properties of CID 140588184?
CID 140588184 has a molecular weight of 382.62 g/mol, XLogP of 5.88, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 140588184 is sourced from PubChem (CID 140588184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).