Basic information
- CAS
42372-33-8- Standard SMILES
COCCOS(=O)(=O)c1cccc2c([O-])c([N+]#N)ccc12- InChIKey
WUZMSQZOWVFNTO-UHFFFAOYSA-N- Molecular formula
- C13H12N2O5S
- Average molar mass
- 308.31 g/mol
- Monoisotopic mass
- 308.04669266
Names & identifiers
- Preferred name
- 1-Naphthalenesulfonic acid, 6-diazo-5,6-dihydro-5-oxo-, 2-methoxyethyl ester
- IUPAC
- 2-diazonio-5-(2-methoxyethoxysulfonyl)naphthalen-1-olate
- English name
- 2-methoxyethyl 6-diazo-5,6-dihydro-5-oxonaphthalene-1-sulphonate
- Molecular formula
- C13H12N2O5S
- Molecular weight
- 308.30978
Names & synonyms
42372-33-81-Naphthalenesulfonic acid, 6-diazo-5,6-dihydro-5-oxo-, 2-methoxyethyl ester4JK5V49ZSBEINECS 255-782-8DTXSID3068388NAPHTHOQUINONE-1,2-DIAZIDE-(2)-5-SULFONIC ACID 2-METHOXYETHYL ESTERRefChem:434946DTXCID70401022-Methoxyethyl 6-diazo-5,6-dihydro-5-oxonaphthalene-1-sulphonateUNII-4JK5V49ZSBSCHEMBL21820179WUZMSQZOWVFNTO-UHFFFAOYSA-N
Show more names
6-Diazo-5,6-dihydro-5-oxo-1-naphthalenesulfonic acid 2-methoxyethyl ester
NS000311652-Methoxyethyl 6-diazo-5-oxo-5,6-dihydronaphthalene-1-sulfonate
Database identifiers
- CAS
42372-33-8- PubChem CID
- 170641
- DTXSID
DTXSID3068388- UNII
- 4JK5V49ZSB
- EC Number
- 255-782-8
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 494
Physicochemical properties
- FDA UNII
- 4 JK5V49ZSB · 4JK5V49ZSB
- EPA Substance Registry System
- 1 · 1-Naphthalenesulfonic acid, 6-diazo-5,6-dihydro-5-oxo-, 2-methoxyethyl ester (42372-33-8)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1-Naphthalenesulfonic acid, 6-diazo-5,6-dihydro-5-oxo-, 2-methoxyethyl ester: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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