(2S)-4-Carbamoyl-2-[(2-nitrophenyl)sulfanylamino]butanoic acid; N-cyclohexylcyclohexanamine

Base Information

• Chemical Name: (2S)-4-Carbamoyl-2-[(2-nitrophenyl)sulfanylamino]butanoic acid; N-cyclohexylcyclohexanamine
• CAS No.: 64143-47-1
• Molecular Formula: C23H36N4O5S
• Molecular Weight: 480.62
• European Community (EC) Number: 264-704-1
• DSSTox Substance ID: DTXSID10214353
• Mol file: 64143-47-1.mol

Synonyms:64143-47-1;EINECS 264-704-1;N2-((2-Nitrophenyl)thio)-L-glutamine, compound with N-dicyclohexylamine (1:1);N-O-Nps-L-glutamine,dicyclohexylammonium salt;(2S)-5-amino-2-[(2-nitrophenyl)sulfanylamino]-5-oxopentanoic acid;N-cyclohexylcyclohexanamine;N2-[(2-nitrophenyl)thio]-L-glutamine, compound with N-dicyclohexylamine (1:1);(2S)-4-Carbamoyl-2-[(2-nitrophenyl)sulfanylamino]butanoic acid;DTXSID10214353;C12H23N.C11H13N3O5S;C12-H23-N.C11-H13-N3-O5-S;dicyclohexylamine (S)-5-amino-2-(2-nitrophenylthioamino)-5-oxopentanoate

Chemical Property of (2S)-4-Carbamoyl-2-[(2-nitrophenyl)sulfanylamino]butanoic acid; N-cyclohexylcyclohexanamine

Chemical Property:

• Vapor Pressure: 5E-16mmHg at 25°C
• Boiling Point: 615.9 °C at 760 mmHg
• Flash Point: 326.3 °C
• PSA: 175.57000
• LogP: 6.15690
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 9
• Exact Mass: 480.24064144
• Heavy Atom Count: 33
• Complexity: 490

Purity/Quality:

99% ^*data from raw suppliers

N-O-NPS-L-GLUTAMINE DICYCLOHEXYLAMMONIUM SALT 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)NC2CCCCC2.C1=CC=C(C(=C1)[N+](=O)[O-])SNC(CCC(=O)N)C(=O)O
• Isomeric SMILES: C1CCC(CC1)NC2CCCCC2.C1=CC=C(C(=C1)[N+](=O)[O-])SN[C@@H](CCC(=O)N)C(=O)O