Basic information
- CAS
73003-79-9- Standard SMILES
CCCOC(=O)c1cc(OS(=O)(=O)c2cccc3c([O-])c([N+]#N)ccc23)c(OS(=O)(=O)c2cccc3c([O-])c([N+]#N)ccc23)c(OS(=O)(=O)c2cccc3c([O-])c([N+]#N)ccc23)c1- InChIKey
SOCWTMTXXZJZPW-UHFFFAOYSA-N- Molecular formula
- C40H24N6O14S3
- Average molar mass
- 908.9 g/mol
- Monoisotopic mass
- 908.05126298
Names & identifiers
- Preferred name
- Benzoic acid, 3,4,5-tris[[(6-diazo-5,6-dihydro-5-oxo-1-naphthalenyl)sulfonyl]oxy]-, propyl ester
- IUPAC
- 5-[2,3-bis[(6-diazonio-5-oxidonaphthalen-1-yl)sulfonyloxy]-5-propoxycarbonylphenoxy]sulfonyl-2-diazonionaphthalen-1-olate
- English name
- propyl 3,4,5-tris[[(6-diazo-5,6-dihydro-5-oxo-1-naphthyl)sulphonyl]oxy]benzoate
- Molecular formula
- C40H24N6O14S3
- Molecular weight
- 908.84536
Names & synonyms
EINECS 277-204-3Benzoic acid, 3,4,5-tris[[(6-diazo-5,6-dihydro-5-oxo-1-naphthalenyl)sulfonyl]oxy]-, propyl esterDTXSID7072709Benzoic acid, 3,4,5-tris(((6-diazo-5,6-dihydro-5-oxo-1-naphthalenyl)sulfonyl)oxy)-, propyl esterRefChem:565703DTXCID804747073003-79-9SOCWTMTXXZJZPW-UHFFFAOYSA-NPropyl 3,4,5-tris(((6-diazo-5,6-dihydro-5-oxo-1-naphthyl)sulphonyl)oxy)benzoateNS00037461Propyl 3,4,5-tris[(6-diazo-5-oxo-5,6-dihydronaphthalene-1-sulfonyl)oxy]benzoatePropyl 3,4,5-tris[[(6-diazo-5,6-dihydro-5-oxo-1-naphthyl)sulfonyl]oxy]benzoate
Show more names
propyl 3,4,5-tris[[(6-diazo-5,6-dihydro-5-oxo-1-naphthyl)sulphonyl]oxy]benzoate3,4,5-Tris(6-diazo-5-oxo-5,6-dihydronaphthalene-1-ylsulfonyloxy)benzoic acid propyl ester3,4,5-Tris[[(5-oxo-6-diazo-5,6-dihydronaphthalene)-1-yl]sulfonyloxy]benzoic acid propyl ester3,4,5-Tris[[[(6-diazo-5,6-dihydro-5-oxonaphthalen)-1-yl]sulfonyl]oxy]benzoic acid propyl ester
Properties
Computed structural properties
- XLogP
- 12.6
- Topological polar surface area
- 335 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 17
- Rotatable bonds
- 13
- Heavy atoms
- 63
- Formal charge
- 0
- Complexity
- 2,060
Physicochemical properties
- EPA Substance Registry System
- 3 · Benzoic acid, 3,4,5-tris[[(6-diazo-5,6-dihydro-5-oxo-1-naphthalenyl)sulfonyl]oxy]-, propyl ester (73003-79-9)
- 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 InformationBenzoic acid, 3,4,5-tris[[(6-diazo-5,6-dihydro-5-oxo-1-naphthalenyl)sulfonyl]oxy]-, propyl ester: ACTIVE
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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