2-Isocyanoadipic acid dimethyl ester

Base Information

• Chemical Name: 2-Isocyanoadipic acid dimethyl ester
• CAS No.: 730964-74-6
• Molecular Formula: C9H13NO4
• Molecular Weight: 199.2
• Hs Code.: 2926909090
• DSSTox Substance ID: DTXSID301251419
• Mol file: 730964-74-6.mol

Synonyms:2-Isocyanoadipic acid dimethyl ester;730964-74-6;DTXSID301251419;AKOS006292941;1,6-DIMETHYL 2-ISOCYANOHEXANEDIOATE;Hexanedioic acid, 2-isocyano-, dimethyl ester

Chemical Property of 2-Isocyanoadipic acid dimethyl ester

Chemical Property:

• PSA: 52.60000
• LogP: 0.02130
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 199.08445790
• Heavy Atom Count: 14
• Complexity: 253

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CCCC(C(=O)OC)[N+]#[C-]