Basic information
- CAS
10290-61-6- Standard SMILES
CSCCC(NC(=O)c1ccccc1)C(=O)O- InChIKey
PPFRJEXUPZWQPI-UHFFFAOYSA-N- Molecular formula
- C12H15NO3S
- Average molar mass
- 253.32 g/mol
- Monoisotopic mass
- 253.07726434
Names & identifiers
- Preferred name
- Benzoyl-dl-methionine
- IUPAC
- 2-benzamido-4-methylsulfanylbutanoic acid
- English name
- N-BENZOYL-DL-METHIONINE
- Molecular formula
- C12H15NO3S
- Molecular weight
- 253.32
Names & synonyms
Benzoyl-dl-methionine4703-38-2N-Benzoyl-dl-methionine2-Benzamido-4-(methylthio)butanoic acidBenzoylmethionine2-benzamido-4-methylsulfanylbutanoic acid99855-84-2MFCD000260444-(methylsulfanyl)-2-(phenylformamido)butanoic acidBz-DL-Met-OHN-benzoylmethionine4-methylthio-2-(phenylcarbonylamino)butanoic acid
Show more names
AURORA 2284AKOS BBS-00007545Methionine, N-benzoyl-N-Benzoyl-(±)-methionineBenzoyl-DL-methionine >
NSC164655Bzo-DL-Met-OHstarbld0046703BZ-DL-METHIONINEN-ben-zoyl-dl-methionineN-Benzoyl-S-methylcysteineN-(phenylcarbonyl)methionineMLS000775497
Database identifiers
- CAS
10290-61-6、4703-38-2- PubChem CID
- 295480
- DTXSID
DTXSID00304217- ChEMBL
CHEMBL1720508- EC Number
- 188-608-3
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 91.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 264
Physicochemical properties
- Melting point
- 152 °C · 152 °C
- Boiling point
- 529.7 · 529.7±45.0 °C(Predicted)
- Density
- 1.2516 · 1.2516 (rough estimate)
- refractive index
- 1.628 · 1.6280 (estimate)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 3.66 · 3.66±0.10(Predicted)
- Hazard Codes
- Xn
- Risk Statements
- 20 · 20/21/22-36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
Safety & regulation
Safety data
- wgk
- 3
- risk_code
- 20/21/22-36/37/38
- hazard_code
- Xn
- safety_code
- 26-36
Chemistry & industry
Applications
Uses2-Benzamido-4-(methylthio)butanoic acid is a Methionine (HY-13694) derivative[1].
Suppliers40 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海景颜化工科技有限公司13817811078 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
云南西力生物技术股份有限公司0871-65217109 · [email protected]
Related reactions
4 records
Compound notes
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