CID 173126547

C20H16Sb — CID 173126547

IUPAC—
SMILESC(=C(c1ccccc1)c1ccccc1)c1ccccc1.[Sb]
InChIInChI=1S/C20H16.Sb/c1-4-10-17(11-5-1)16-20(18-12-6-2-7-13-18)19-14-8-3-9-15-19;/h1-16H;
InChIKeyTYLJDUHYONPOSB-UHFFFAOYSA-N
MW378.11 g/mol
LogP4.89
Rot. Bonds3

About CID 173126547

CID 173126547 (PubChem CID 173126547) has the molecular formula C20H16Sb and a molecular weight of 378.11 g/mol.

Molecular Properties

Compound NameCID 173126547
PubChem CID173126547
Molecular FormulaC20H16Sb
Molecular Weight378.11 g/mol
Exact Mass377.03
IUPAC Name—
SMILESC(=C(c1ccccc1)c1ccccc1)c1ccccc1.[Sb]
InChIInChI=1S/C20H16.Sb/c1-4-10-17(11-5-1)16-20(18-12-6-2-7-13-18)19-14-8-3-9-15-19;/h1-16H;
InChIKeyTYLJDUHYONPOSB-UHFFFAOYSA-N
XLogP4.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.11
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 172843956
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1-(1,2-diphenylethenyl)-4-phenylbenzene
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1,2-diphenylethenylbenzene;2-methylphenol
CID 159908422
1-[(E)-1,2-diphenylethenyl]-3,5-dimethylbenzene
CID 102283566
1-[(E)-1,2-diphenylethenyl]-3-phenylbenzene
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2,5-bis[(E)-1,2-diphenylethenyl]thiophene
CID 12965056
1-(2,2-diphenylethenyl)-4-[2-[4-[4-[2-[4-(2,2-diphenylethenyl)phenyl]ethenyl]phenyl]phenyl]ethenyl]benzene
CID 59965271

Frequently Asked Questions

What is the IUPAC name of CID 173126547?
The IUPAC name of CID 173126547 (CID 173126547) is not available.
What is the SMILES notation for CID 173126547?
The canonical SMILES for CID 173126547 is C(=C(c1ccccc1)c1ccccc1)c1ccccc1.[Sb].
What is the InChIKey of CID 173126547?
The InChIKey is TYLJDUHYONPOSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16.Sb/c1-4-10-17(11-5-1)16-20(18-12-6-2-7-13-18)19-14-8-3-9-15-19;/h1-16H;.
What are the key properties of CID 173126547?
CID 173126547 has a molecular weight of 378.11 g/mol, XLogP of 4.89, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173126547 is sourced from PubChem (CID 173126547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).