2,4-Dimethylhepta-2,2-dienal

Base Information

• Chemical Name: 2,4-Dimethylhepta-2,2-dienal
• CAS No.: 85136-08-9
• Molecular Formula: C9H16O
• Molecular Weight: 138.21
• Hs Code.: 2912190090
• European Community (EC) Number: 285-731-5
• Nikkaji Number: J1.769.470G
• Mol file: 85136-08-9.mol

Synonyms:2,4-Dimethylhepta-2,2-dienal;EINECS 285-731-5;85136-08-9;2,4 - dimethylhepta - 2,2 - dienal;SCHEMBL1189177;(E)-2,4-Dimethyl-2-heptenal

Chemical Property of 2,4-Dimethylhepta-2,2-dienal

Chemical Property:

• Vapor Pressure: 0.374mmHg at 25°C
• Refractive Index: n20/D 1.4664(lit.)
• Boiling Point: 197.7°Cat760mmHg
• Flash Point: 56.7°C
• PSA: 17.07000
• Density: 0.833g/cm³
• LogP: 2.56780
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 140.120115130
• Heavy Atom Count: 10
• Complexity: 125

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(C)C=C(C)C=O
• Isomeric SMILES: CCCC(C)/C=C(\C)/C=O