Basic information
- CAS
1217678-56-2- Standard SMILES
O=C(NNC(=O)c1ccccc1S)c1ccccc1S- InChIKey
BCDWFVITTFIUNV-UHFFFAOYSA-N- Molecular formula
- C14H12N2O2S2
- Average molar mass
- 304.4 g/mol
- Monoisotopic mass
- 304.03401998
Names & identifiers
- Preferred name
- N,N'-Bis(2-mercaptobenzoyl)hydrazide
- IUPAC
- 2-sulfanyl-N'-(2-sulfanylbenzoyl)benzohydrazide
- English name
- (+/-)-trans-1,2-Bis(2-mercaptoacetamido)cyclohexane disulfide
- Molecular formula
- C10H16N2O2S2
- Molecular weight
- 260.38
Names & synonyms
N,N'-Bis(2-mercaptobenzoyl)hydrazide292615-41-92-sulfanyl-n'-(2-sulfanylbenzoyl)benzohydrazide2-Mercapto-N'-(2-mercaptobenzoyl)benzohydrazideCHEMBL157428BIS(THIOSALICYL)HYDRAZIDENSC704784BMC-DisulfideSCHEMBL7885471DTXSID90327935BDBM50121971(8aR,12aR)-rel-Octahydro-4,5,1,8-benzodithiadiazecine-2,7(3H,6H)-dione
Show more names
rac-trans-1,2-Bis(2-MercaptoacetaMido)cyclohexane Disulfide(+/-)-trans-1,2-Bis(2-mercaptoacetamido)cyclohexane disulfide4,5,1,8-Benzodithiadiazecine-2,7(3H,6H)-dione, octahydro-, (8aR,12aR)-rel-
NSC-704784NCI60_0374112-Mercapto-benzoic acid N''-(2-mercapto-benzoyl)-hydrazide
Database identifiers
- CAS
1217678-56-2、292615-41-9- PubChem CID
- 397256
- DTXSID
DTXSID90327935- ChEMBL
CHEMBL157428
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 60.2 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 331
Physicochemical properties
- Melting point
- 247 °C · 247°C
- Boiling point
- 591.6 · 591.6±50.0 °C(Predicted)
- Density
- 1.22 · 1.220±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- DMSO, Ethyl Acetate
- form
- Solid
- pka
- 13.65 · 13.65±0.20(Predicted)
- color
- Off-White
Chemistry & industry
Applications
Uses(+/-)-TRANS-1,2-BIS(2-MERCAPTOACETAMIDO)CYCLOHEXANE DISULFIDE is a useful synthetic intermediate
Suppliers6 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海陶素生化科技有限公司021-33632979 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
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Compound notes
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