Basic information
- CAS
17527-17-2- Standard SMILES
Nc1cc(S(=O)(=O)O)c2cc([N+](=O)[O-])cc(S(=O)(=O)O)c2c1- InChIKey
PEFKYEIJIGWGBJ-UHFFFAOYSA-N- Molecular formula
- C10H8N2O8S2
- Average molar mass
- 348.3 g/mol
- Monoisotopic mass
- 347.97220756
Names & identifiers
- Preferred name
- 3-Amino-7-nitronaphthalene-1,5-disulphonic acid
- IUPAC
- 3-amino-7-nitronaphthalene-1,5-disulfonic acid
- English name
- 3-amino-7-nitronaphthalene-1,5-disulphonic acid
- Molecular formula
- C10H8N2O8S2
- Molecular weight
- 348.31
Names & synonyms
17527-17-23-Amino-7-nitronaphthalene-1,5-disulphonic acid3-Amino-7-nitro-1,5-naphthalenedisulfonic acidEINECS 241-525-7DTXSID80169962RefChem:497502DTXCID0092453241-525-73-amino-7-nitronaphthalene-1,5-disulfonic acidSCHEMBL343183SCHEMBL343184SCHEMBL29562985
Show more names
1,5-Naphthalenedisulfonic acid, 3-amino-7-nitro-6-nitro-2-amino-naphthalene-4,8-disulphonic acid
PEFKYEIJIGWGBJ-UHFFFAOYSA-NAKOS016007796DB-348107NS000257533-amino-7-nitronaphthalene-1,5-disulfonicacid
Database identifiers
- CAS
17527-17-2- PubChem CID
- 87148
- DTXSID
DTXSID80169962- EC Number
- 241-525-7
- Nikkaji
- J287.072J
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 197 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 644
Physicochemical properties
- Density
- 1.901 · 1.901±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- -1.68 · -1.68±0.40(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers3 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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