(1S,2S)-N,N'-Dimethyl-N,N'-bis(3,3-dimethylbutyl)cyclohexane-1,2-diamine

• Catalog Number: ACM767291678
• Product Name: (1S,2S)-N,N'-Dimethyl-N,N'-bis(3,3-dimethylbutyl)cyclohexane-1,2-diamine
• CAS: 767291-67-8
• Category: Heterocyclic Organic Compound
• Synonyms: X6097; CTK5E3358; 767291-67-8; MFCD11869717; (1S,2S)-N1,N2-Bis(3,3-dimethyl butyl)-N1,N2-dimethyl-1,2-diaminocyclohexane; AKOS015841829; ZINC44075626; KS-0000149B; TR-037745; (1S,2S)-N,N'-Dimethyl-N,N'-bis(3,3-dimethylbutyl)cyclohexane-1,2-diamine
• IUPAC Name: (1S,2S)-1-N,2-N-bis(3,3-dimethylbutyl)-1-N,2-N-dimethylcyclohexane-1,2-diamine
• Molecular Weight: 310.57g/mol
• Molecular Formula: C20H42N2
• Canonical SMILES: CC(C)(C)CCN(C)C1CCCCC1N(C)CCC(C)(C)C
• InChI: InChI=1S/C20H42N2/c1-19(2,3)13-15-21(7)17-11-9-10-12-18(17)22(8)16-14-20(4,5)6/h17-18H,9-16H2,1-8H3/t17-,18-/m0/s1
• InChI Key: VGCWVKVNKNXOGZ-ROUUACIJSA-N
• Storage: Room temperature.
• Complexity: 279
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 2
• Exact Mass: 310.335g/mol
• H-Bond Acceptor: 2
• Heavy Atom Count: 22
• Monoisotopic Mass: 310.335g/mol
• Rotatable Bond Count: 8
• Topological Polar Surface Area: 6.5A^2