3-(Aminomethyl)-3,5,5-trimethylcyclohexan-1-amine;azepan-2-one;benzene-1,3-dicarboxylic acid

Base Information

• Chemical Name: 3-(Aminomethyl)-3,5,5-trimethylcyclohexan-1-amine;azepan-2-one;benzene-1,3-dicarboxylic acid
• CAS No.: 29009-00-5
• Molecular Formula: C24H39N3O5
• Molecular Weight: 449.58400
• Mol file: 29009-00-5.mol

Synonyms:29009-00-5;(C10-H22-N2.C8-H6-O4.C6-H11-N-O)x-

Chemical Property of 3-(Aminomethyl)-3,5,5-trimethylcyclohexan-1-amine;azepan-2-one;benzene-1,3-dicarboxylic acid

Chemical Property:

• Boiling Point: 217.2oC at 760 mmHg
• Flash Point: 98.7oC
• PSA: 159.23000
• LogP: 4.92490
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 449.28897135
• Heavy Atom Count: 32
• Complexity: 435

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CC(CC(C1)(C)CN)N)C.C1CCC(=O)NCC1.C1=CC(=CC(=C1)C(=O)O)C(=O)O