Quinoline, sulfate (1:1)
Basic information
- CAS
41949-04-6- Standard SMILES
O=S(=O)(O)O.c1ccc2ncccc2c1- InChIKey
WSZKUEZEYFNPID-UHFFFAOYSA-N- Molecular formula
- C9H9NO4S
- Average molar mass
- 227.24 g/mol
- Monoisotopic mass
- 227.02522894
Names & identifiers
- Preferred name
- Quinoline, sulfate (1:1)
- IUPAC
- quinoline;sulfuric acid
- English name
- quinolinium hydrogen sulphate
- Molecular formula
- C9H9NO4S
- Molecular weight
- 227.23706
Names & synonyms
Quinoline bisulfateQuinoline, sulfate (1:1)RefChem:1097871208-492-0530-66-5Quinolinium hydrogen sulphateQuinoline SulphateQuinoline, sulfateQuinoline sulfate (1:1)quinoline;sulfuric acid41949-04-6MFCD00054376
Show more names
EINECS 208-492-0Chinolinsulfatsulfuric acid quinolineSCHEMBL21535DTXSID8031996SCHEMBL29710686Sulfuric acid--quinoline (1/1)AKOS015856624
Database identifiers
- CAS
41949-04-6、530-66-5- PubChem CID
- 10744
- DTXSID
DTXSID8031996- EC Number
- 208-492-0
Properties
Computed structural properties
- Topological polar surface area
- 95.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 193
Physicochemical properties
- Melting point
- 162 · 162-164 °C
- storage temp.
- Inert atmosphere,Room Temperature
- EPA Substance Registry System
- Quinoline sulfate (530-66-5)
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H312-H315-H318-H332-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P310-P312-P321-P322-P330-P332+P313-P362-P363-P403+P233-P405-P501
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
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- Hazard statements
- H302-H312-H315-H318-H332-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P310-P312-P321-P322-P330-P332+P313-P362-P363-P403+P233-P405-P501
Related reactions
1 records
Compound notes
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