2,4-dimethylpenta-1,3-diene;rhodium

C7H12Rh — CID 175138892

IUPAC2,4-dimethylpenta-1,3-diene;rhodium
SMILESC=C(C)C=C(C)C.[Rh]
InChIInChI=1S/C7H12.Rh/c1-6(2)5-7(3)4;/h5H,1H2,2-4H3;
InChIKeyXVARFMPEDPLJBO-UHFFFAOYSA-N
MW199.08 g/mol
LogP2.53
Rot. Bonds1

About 2,4-dimethylpenta-1,3-diene;rhodium

2,4-dimethylpenta-1,3-diene;rhodium (PubChem CID 175138892) has the molecular formula C7H12Rh and a molecular weight of 199.08 g/mol. Its IUPAC name is 2,4-dimethylpenta-1,3-diene;rhodium.

Molecular Properties

Compound Name2,4-dimethylpenta-1,3-diene;rhodium
PubChem CID175138892
Molecular FormulaC7H12Rh
Molecular Weight199.08 g/mol
Exact Mass199.00
IUPAC Name2,4-dimethylpenta-1,3-diene;rhodium
SMILESC=C(C)C=C(C)C.[Rh]
InChIInChI=1S/C7H12.Rh/c1-6(2)5-7(3)4;/h5H,1H2,2-4H3;
InChIKeyXVARFMPEDPLJBO-UHFFFAOYSA-N
XLogP2.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.08
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 2,4-dimethylpenta-1,3-diene;rhodium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,4-dimethylpenta-1,3-diene;ethane
CID 144511028
carbanide;bis(2,4-dimethylpenta-1,3-diene);ruthenium(2+)
CID 162297697
(3E)-2,6-dimethyl-4-(trifluoromethyl)hepta-1,3,5-triene
CID 143951906
(3E)-4-(difluoromethyl)-2,6-dimethylhepta-1,3,5-triene
CID 88886456
4-fluoro-2-methylpenta-1,3-diene
CID 91548369
3-(2-methylprop-2-enylidene)penta-1,4-diene-2,4-diol
CID 142358246
(3Z)-2-chloro-3,5-dimethylhexa-1,3,5-triene
CID 142150750
(1E)-1-amino-3-methylbuta-1,3-dien-1-ol;ethane
CID 142851465
[(3E)-2,5-dimethylhexa-1,3,5-trien-3-yl]thallium
CID 142529132
4-methyl-2-methylidenepent-3-enal
CID 118287725
ethane;(3E)-5-methylhexa-1,3,5-triene-2,3-diol
CID 143169625
(2E)-2,4-dimethylpenta-2,4-dien-1-amine
CID 126656213

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethylpenta-1,3-diene;rhodium?
The IUPAC name of 2,4-dimethylpenta-1,3-diene;rhodium (CID 175138892) is 2,4-dimethylpenta-1,3-diene;rhodium.
What is the SMILES notation for 2,4-dimethylpenta-1,3-diene;rhodium?
The canonical SMILES for 2,4-dimethylpenta-1,3-diene;rhodium is C=C(C)C=C(C)C.[Rh].
What is the InChIKey of 2,4-dimethylpenta-1,3-diene;rhodium?
The InChIKey is XVARFMPEDPLJBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12.Rh/c1-6(2)5-7(3)4;/h5H,1H2,2-4H3;.
What are the key properties of 2,4-dimethylpenta-1,3-diene;rhodium?
2,4-dimethylpenta-1,3-diene;rhodium has a molecular weight of 199.08 g/mol, XLogP of 2.53, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylpenta-1,3-diene;rhodium is sourced from PubChem (CID 175138892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).