2H-Azepin-2-one, hexahydro-1-(3,7,11-trimethyl-2,6,10-dodecatrienyl)-, (E,E)-

Base Information

• Chemical Name: 2H-Azepin-2-one, hexahydro-1-(3,7,11-trimethyl-2,6,10-dodecatrienyl)-, (E,E)-
• CAS No.: 110261-30-8
• Molecular Formula: C21H35 N O
• Molecular Weight: 317.5087
• Nikkaji Number: J325.991I
• Mol file: 110261-30-8.mol

Synonyms:1-FACHO;1-farnesylazacycloheptan-2-one;1-farnesylazacycloheptan-2-one, (E,E)-isomer;1-farnesylazacycloheptan-2-one, (Z,E)-isomer

Chemical Property of 2H-Azepin-2-one, hexahydro-1-(3,7,11-trimethyl-2,6,10-dodecatrienyl)-, (E,E)-

Chemical Property:

• Boiling Point: 457.4°Cat760mmHg
• Flash Point: 185.5°C
• Density: 0.922g/cm³
• XLogP3: 5.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 8
• Exact Mass: 317.271864740
• Heavy Atom Count: 23
• Complexity: 453

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CC(=CCCC(=CCCC(=CCN1CCCCCC1=O)C)C)C
• Isomeric SMILES: CC(=CCC/C(=C/CC/C(=C/CN1CCCCCC1=O)/C)/C)C

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