Ethylsulfamic acid
Basic information
- CAS
4626-94-2- Standard SMILES
CCNS(=O)(=O)O- InChIKey
SIVVHUQWDOGLJN-UHFFFAOYSA-N- Molecular formula
- C2H7NO3S
- Average molar mass
- 125.15 g/mol
- Monoisotopic mass
- 125.01466426
Names & identifiers
- Preferred name
- Ethylsulfamic acid
- IUPAC
- ethylsulfamic acid
- English name
- ethylsulphamic acid
- Molecular formula
- C2H7NO3S
- Molecular weight
- 125.15
Names & synonyms
ethylsulfamic acid4626-94-2N-Ethylsulfamic acidSulfamic acid, N-ethyl-ethylaminosulfonic acidSulfamic acid, ethyl-ethylsulfamicacidethyl-sulfamic acidNSC54924Caprylic Acid Impurity 27SCHEMBL54034SCHEMBL177824
Show more names
Einecs 225-038-7ethylsulphamic acid
SCHEMBL242031SCHEMBL299874SCHEMBL5896893SCHEMBL11454513DTXSID70963532ALBB-018649AR-1K6530MFCD19105012
Database identifiers
- CAS
4626-94-2- PubChem CID
- 244259
- DTXSID
DTXSID70963532- EC Number
- 225-038-7
- Nikkaji
- J297.852K
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 74.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 120
Physicochemical properties
- Melting point
- 170 · 170-171 °C
- Density
- 1.407 · 1.407±0.06 g/cm3(Predicted)
- pka
- -8.47 · -8.47±0.27(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
1 records
Compound notes
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