Basic information
- CAS
73424-46-1- Standard SMILES
Cc1ccc(S(=O)(=O)NN=C2CCc3ccccc32)cc1- InChIKey
YOWVLOMBIBKGFG-UHFFFAOYSA-N- Molecular formula
- C16H16N2O2S
- Average molar mass
- 300.4 g/mol
- Monoisotopic mass
- 300.09324893
Names & identifiers
- Preferred name
- n'-(2,3-Dihydro-1h-inden-1-ylidene)-4-methylbenzenesulfonohydrazide
- IUPAC
- N-(2,3-dihydroinden-1-ylideneamino)-4-methylbenzenesulfonamide
- English name
- N'-(2,3-dihydro-1H-inden-1-ylidene)-4-methylbenzenesulfonohydrazide
- Molecular formula
- C16H16N2O2S
- Molecular weight
- 300.38
Names & synonyms
n'-(2,3-dihydro-1h-inden-1-ylidene)-4-methylbenzenesulfonohydrazideMLS002920134CHEMBL2137242DTXSID10994148SMR001797731N'-(2,3-Dihydro-1H-inden-1-ylidene)-4-methylbenzene-1-sulfonohydrazide(E)-N'-(2,3-Dihydro-1H-inden-1-ylidene)-4-methylbenzenesulfonohydrazideBenzenesulfonic acid, 4-methyl-, 2-(2,3-dihydro-1H-inden-1-ylidene)hydrazide
Database identifiers
- CAS
73424-46-1- PubChem CID
- 280412
- DTXSID
DTXSID10994148- ChEMBL
CHEMBL2137242
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 66.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 487
Physicochemical properties
- Melting point
- 192 °C · 192 °C
- Boiling point
- 474.2 · 474.2±48.0 °C(Predicted)
- Density
- 1.28 · 1.28±0.1 g/cm3(Predicted)
- pka
- 9.54 · 9.54±0.20(Predicted)
Chemistry & industry
Suppliers6 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海颐碳化学科技有限公司13774412103 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
上海林栎生物科技有限公司13761635123 · [email protected]
苏州诺行贸易有限公司0512-65816829 18662214788 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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