Isethionic acid ammonium salt - CAS 57267-78-4
Catalog: |
BB029622 |
Product Name: |
Isethionic acid ammonium salt |
CAS: |
57267-78-4 |
Synonyms: |
azanium;2-hydroxyethanesulfonate |
IUPAC Name: | azanium;2-hydroxyethanesulfonate |
Description: | Isethionic acid ammonium salt (CAS# 57267-78-4) is a useful research chemical compound. |
Molecular Weight: | 143.16 |
Molecular Formula: | C2H9NO4S |
Canonical SMILES: | C(CS(=O)(=O)[O-])O.[NH4+] |
InChI: | InChI=1S/C2H6O4S.H3N/c3-1-2-7(4,5)6;/h3H,1-2H2,(H,4,5,6);1H3 |
InChI Key: | LLOHIFXFHGMBNO-UHFFFAOYSA-N |
Purity: | > 98 % |
Density: | 1.625 g/cm3 |
Appearance: | White powder, crystals, crystalline powder and/or chunks |
MDL: | MFCD00012847 |
LogP: | 0.27120 |
GHS Hazard Statement: | H315 (95.92%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113045459-A | Method for removing sulfate radical in isethionate | 20210331 |
CN-112979505-A | Method for preparing taurine | 20210304 |
CN-113200878-A | Circulation method for producing taurine from ethanolamine | 20200909 |
CN-113200879-A | Circulation method for producing taurine from ethanolamine | 20200909 |
CN-113214095-A | Circulation method for producing taurine from ethanolamine | 20200909 |
Complexity: | 104 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 143.02522894 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 143.02522894 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 86.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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