CID 134902621

C16H16KPr — CID 134902621

IUPAC—
SMILESC1=C/C=C\C=C/C=C\1.C1=C/C=C\C=C/C=C\1.[K].[Pr]
InChIInChI=1S/2C8H8.K.Pr/c2*1-2-4-6-8-7-5-3-1;;/h2*1-8H;;/b2*2-1-,3-1-,4-2-,5-3-,6-4-,7-5?,8-6?,8-7?;;
InChIKeyARXMTQGVDOYCDS-HSFJRFSNSA-N
MW388.31 g/mol
LogP4.07
Rot. Bonds

About CID 134902621

CID 134902621 (PubChem CID 134902621) has the molecular formula C16H16KPr and a molecular weight of 388.31 g/mol.

Molecular Properties

Compound NameCID 134902621
PubChem CID134902621
Molecular FormulaC16H16KPr
Molecular Weight388.31 g/mol
Exact Mass388.00
IUPAC Name—
SMILESC1=C/C=C\C=C/C=C\1.C1=C/C=C\C=C/C=C\1.[K].[Pr]
InChIInChI=1S/2C8H8.K.Pr/c2*1-2-4-6-8-7-5-3-1;;/h2*1-8H;;/b2*2-1-,3-1-,4-2-,5-3-,6-4-,7-5?,8-6?,8-7?;;
InChIKeyARXMTQGVDOYCDS-HSFJRFSNSA-N
XLogP4.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.31
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 134902621?
The IUPAC name of CID 134902621 (CID 134902621) is not available.
What is the SMILES notation for CID 134902621?
The canonical SMILES for CID 134902621 is C1=C/C=C\C=C/C=C\1.C1=C/C=C\C=C/C=C\1.[K].[Pr].
What is the InChIKey of CID 134902621?
The InChIKey is ARXMTQGVDOYCDS-HSFJRFSNSA-N. The full InChI is InChI=1S/2C8H8.K.Pr/c2*1-2-4-6-8-7-5-3-1;;/h2*1-8H;;/b2*2-1-,3-1-,4-2-,5-3-,6-4-,7-5?,8-6?,8-7?;;.
What are the key properties of CID 134902621?
CID 134902621 has a molecular weight of 388.31 g/mol, XLogP of 4.07, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134902621 is sourced from PubChem (CID 134902621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).