Basic information
- CAS
6948-63-6- Standard SMILES
COc1cc(C(=O)NNS(=O)(=O)c2ccccc2)cc(OC)c1OC- InChIKey
VIFMYRYDXHXIFE-UHFFFAOYSA-N- Molecular formula
- C16H18N2O6S
- Average molar mass
- 366.4 g/mol
- Monoisotopic mass
- 366.08855747
Names & identifiers
- Preferred name
- N'-(benzenesulfonyl)-3,4,5-trimethoxybenzohydrazide
- IUPAC
- N'-(benzenesulfonyl)-3,4,5-trimethoxybenzohydrazide
- English name
- 1-(Phenylsulfonyl)-2-(3,4,5-trimethoxybenzoyl)hydrazine
- Molecular formula
- C16H18N2O6S
- Molecular weight
- 366.39
Names & synonyms
6948-63-6N'-(benzenesulfonyl)-3,4,5-trimethoxybenzohydrazideNSC55795NCIOpen2_007537DTXSID60989428NSC-55795AKOS003421504N'-(3,4,5-Trimethoxybenzoyl)benzenesulfonohydrazideN-(Benzenesulfonyl)-3,4,5-trimethoxybenzene-1-carbohydrazonic acid1-(Phenylsulfonyl)-2-(3,4,5-trimethoxybenzoyl)hydrazineBenzoic acid, 3,4,5-trimethoxy-, 2-(phenylsulfonyl)hydrazide
Database identifiers
- CAS
6948-63-6- PubChem CID
- 244698
- DTXSID
DTXSID60989428
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 515
Physicochemical properties
- Density
- 1.307 · 1.307±0.06 g/cm3(Predicted)
- pka
- 7.2 · 7.20±0.25(Predicted)
Chemistry & industry
Suppliers1 total
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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