Basic information
- Standard SMILES
Cc1cc(=O)oc2cc(OS(=O)(=O)[O-])c(OS(=O)(=O)[O-])cc12.[Na+].[Na+]- InChIKey
YCZIKIZDMUKKPA-UHFFFAOYSA-L- Molecular formula
- C10H6Na2O10S2
- Average molar mass
- 396.3 g/mol
- Monoisotopic mass
- 395.91977695
Names & identifiers
- Preferred name
- Sulmarin disodium
- IUPAC
- disodium;(4-methyl-2-oxo-6-sulfonatooxychromen-7-yl) sulfate
- English name
- disodium (4-methyl-2-oxo-2H-1-benzopyran-6,7-diyl)disulphate
- Molecular formula
- C10H8O10S2.2Na
- Molecular weight
- 0
Names & synonyms
Sulmarin disodium1040-23-9EINECS 213-865-6UNII-719219P18R6,7-Dihydroxy-4-methylcoumarin bis(hydrogen sulfate) disodium salt719219P18RDTXSID60146211SULMARIN DISODIUM [WHO-DD]COUMARIN, 6,7-DIHYDROXY-4-METHYL-, BIS(HYDROGEN SULFATE), DISODIUM SALTMG 143MG-1434-METHYLESCULETOL DISULFATE DISODIUM SALT
Show more names
4-Methyl-6,7-bis(sodiosulfooxy)-2H-1-benzopyran-2-one
RefChem:186734DTXCID3068702Disodium (4-methyl-2-oxo-2H-1-benzopyran-6,7-diyl)disulphatedisodium;(4-methyl-2-oxo-6-sulfonatooxychromen-7-yl) sulfateorb2815571YCZIKIZDMUKKPA-UHFFFAOYSA-LT202135Q27265943
Database identifiers
- CAS
1040-23-9- PubChem CID
- 13962
- DTXSID
DTXSID60146211- UNII
- 719219P18R
- EC Number
- 213-865-6
- Nikkaji
- J217.159G
Properties
Computed structural properties
- Topological polar surface area
- 176 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 654
Physicochemical properties
- FDA UNII
- 719219 P18R · 719219P18R
Chemistry & industry
Suppliers1 total
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
Related reactions
0 records
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Linked notes
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