S-Nitroso-N-valeryl-D,L-penicillamine

Base Information

• Chemical Name: S-Nitroso-N-valeryl-D,L-penicillamine
• CAS No.: 225233-99-8
• Molecular Formula: C10H18N2O4S
• Molecular Weight: 262.33
• DSSTox Substance ID: DTXSID30274459
• Mol file: 225233-99-8.mol

Synonyms:snvp;S-Nitroso-N-valeryl-D,L-penicillamine;225233-99-8;3-methyl-3-nitrososulfanyl-2-(pentanoylamino)butanoic acid;3-(Nitrosothio)-N-(1-oxopentyl)valine;SCHEMBL17718101;DTXSID30274459;S-nitroso-N-valeryl-dl-penicillamine;FT-0673003;J-014750

Chemical Property of S-Nitroso-N-valeryl-D,L-penicillamine

Chemical Property:

• PSA: 124.62000
• LogP: 2.77950
• Storage Temp.: -86°C Freezer
• Solubility.: Chloroform, Methanol
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 262.09872823
• Heavy Atom Count: 17
• Complexity: 294

Purity/Quality:

95% ^*data from raw suppliers

S-Nitroso-N-valeryl-D,L-penicillamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(=O)NC(C(=O)O)C(C)(C)SN=O
• Uses: Exhibits higher lipophilicity and greater stability in solution than SNAP (Catalogue Number N522500). Its decompostion is accelerated by the presence of Cu(II) and cysteine Exhibits higher lipophilicity and greater stability in solution than SNAP (N522500). Its decompostion is accelerated by the presence of Cu(II) and cysteine.

Technology Process of S-Nitroso-N-valeryl-D,L-penicillamine

There total 3 articles about S-Nitroso-N-valeryl-D,L-penicillamine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

N-valeryl-D-penicillamine → S-nitroso-N-valeryl-D-penicillamine (225233-99-8)

Guidance literature:

With hydrogenchloride; sodium nitrite; In dichloromethane;

DOI:10.1016/S0014-2999(00)00777-9

Reference yield:

3,3-dimethyl-D-cysteine (52-67-5) → S-nitroso-N-valeryl-D-penicillamine (225233-99-8)

Guidance literature:

Multi-step reaction with 2 steps

1: tetrahydrofuran; H₂O / 20 °C

2: HCl; sodium nitrite / CH₂Cl₂

With hydrogenchloride; sodium nitrite; In tetrahydrofuran; dichloromethane; water;

DOI:10.1016/S0014-2999(00)00777-9

Reference yield:

pentanoic anhydride (2082-59-9) → S-nitroso-N-valeryl-D-penicillamine (225233-99-8)

Guidance literature:

Multi-step reaction with 2 steps

1: tetrahydrofuran; H₂O / 20 °C

2: HCl; sodium nitrite / CH₂Cl₂

With hydrogenchloride; sodium nitrite; In tetrahydrofuran; dichloromethane; water;

DOI:10.1016/S0014-2999(00)00777-9

upstream raw materials:

3,3-dimethyl-D-cysteine

pentanoic anhydride

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