CID 15771517

C8H12Sb — CID 15771517

IUPAC—
SMILESCC1=C(C)C(C)=C(C)[Sb]1
InChIInChI=1S/C8H12.Sb/c1-5-7(3)8(4)6-2;/h1-4H3;
InChIKeyTWTUNQMWGFMZCT-UHFFFAOYSA-N
MW229.94 g/mol
LogP2.29
Rot. Bonds

About CID 15771517

CID 15771517 (PubChem CID 15771517) has the molecular formula C8H12Sb and a molecular weight of 229.94 g/mol.

Molecular Properties

Compound NameCID 15771517
PubChem CID15771517
Molecular FormulaC8H12Sb
Molecular Weight229.94 g/mol
Exact Mass229.00
IUPAC Name—
SMILESCC1=C(C)C(C)=C(C)[Sb]1
InChIInChI=1S/C8H12.Sb/c1-5-7(3)8(4)6-2;/h1-4H3;
InChIKeyTWTUNQMWGFMZCT-UHFFFAOYSA-N
XLogP2.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.94
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 CID 15771517?
The IUPAC name of CID 15771517 (CID 15771517) is not available.
What is the SMILES notation for CID 15771517?
The canonical SMILES for CID 15771517 is CC1=C(C)C(C)=C(C)[Sb]1.
What is the InChIKey of CID 15771517?
The InChIKey is TWTUNQMWGFMZCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12.Sb/c1-5-7(3)8(4)6-2;/h1-4H3;.
What are the key properties of CID 15771517?
CID 15771517 has a molecular weight of 229.94 g/mol, XLogP of 2.29, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 15771517 is sourced from PubChem (CID 15771517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).