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Basic information
- CAS
15537-71-0- Standard SMILES
CC(=O)N[C@@H](C(=O)O)C(C)(C)S- InChIKey
MNNBCKASUFBXCO-YFKPBYRVSA-N- Molecular formula
- C7H13NO3S
- Average molar mass
- 191.252 g/mol
- Monoisotopic mass
- 191.06161428
Names & identifiers
- Preferred name
- N-Acetyl-D-penicillamine
- English name
- N-Acetyl-3-mercapto-D-valine
- Molecular formula
- C7H13NO3S
- Molecular weight
- 191.25
Names & synonyms
Ac-D-Pen-OHN-ACETYL-D-PENICILLAMINEN-Acetyl-3-mercapto-D-valineD-Valine, N-acetyl-3-mercapto-N-acetyl-3-dimethyl-DL-cysteineN-Acetyl-D-penicillamineN-Acetyl-D-penicillaminebiochemikaAcetochlor Impurity 6 (Dimethachlor)-2-Acetamido-3-mercapto-3-methylbutanoic acid(S)-2-Acetamido-3-mercapto-3-methylbutanoic acid
Database identifiers
- CAS
15537-71-0- PubChem CID
- 65532
- DTXSID
DTXSID701030813- ChEBI
CHEBI:61198- UNII
- WO11M5K6OR
- EC Number
- 239-585-4
- Nikkaji
- J16.036I
Properties
Physicochemical properties
- Melting point
- 185 · 185-190 °C (dec.)
- Boiling point
- 392.7 · 392.7±37.0 °C(Predicted)
- Density
- 1.201 · 1.201±0.06 g/cm3(Predicted)
- storage temp.
- Inert atmosphere,Room Temperature
- solubility
- Ethanol (Slightly), Methanol (Slightly), Trifluoroacetic Acid (Slightly)
- form
- Solid
- pka
- 3.39 · 3.39±0.10(Predicted)
- color
- White to Off-White
- optical activity
- 20 · [α]20/D +10±2°, c = 1% in ethanol
- Merck
- 13 · 13,100
- BRN
- 1724742 · 1724742
- Major Application
- peptide synthesis
- InChI
- 1S/C7H13NO3S/c1-4(9)8-5(6(10)11)7(2,3)12/h5,12H,1-3H3,(H,8,9)(H,10,11)/t5-/m0/s1
- InChIKey
- MNNBCKASUFBXCO-YFKPBYRVSA-N
- SMILES
- CC(=O)N[C@@H](C(O)=O)C(C)(C)S || CC(=O)N[C@@H](C(O)=O)C(C)(C)S
- FDA UNII
- 11 M5K6OR · WO11M5K6OR
- UNSPSC Code
- 12352116 · 12352116
- NACRES
- 26 · NA.26
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 302 · P302+P352-P305+P351+P338
- target organs
- Respiratory system
- PPE
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- F
- 10-23
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P302+P352-P305+P351+P338
Chemistry & industry
Applications
UsesProtected Penicillamin.
Upstream & downstream products
Upstream raw materials
Suppliers55 total
上海康恩博医药科技有限公司17510465506 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
江苏吉泰肽业科技有限公司051580855088 18762539991 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Compound Net Biotechnology Inc.15266686121 · [email protected]
Related reactions
2 records
Compound notes
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