Basic information
- CAS
392-86-9- Standard SMILES
Nc1ccccc1S(=O)(=O)F- InChIKey
OYJFEOGFHBNHRT-UHFFFAOYSA-N- Molecular formula
- C6H6FNO2S
- Average molar mass
- 175.18 g/mol
- Monoisotopic mass
- 175.01032777
Names & identifiers
- Preferred name
- 2-Aminobenzenesulfonyl fluoride
- IUPAC
- 2-aminobenzenesulfonyl fluoride
- English name
- 2-aminobenzenesulphonyl fluoride
- Molecular formula
- C6H6FNO2S
- Molecular weight
- 175.18
Names & synonyms
392-86-92-aminobenzene-1-sulfonyl fluoride2-Aminobenzenesulphonyl fluoride2-aminobenzenesulfonyl fluorideBenzenesulfonyl fluoride, 2-amino-83K4AZ4EUKo-aminobenzenesulfonyl fluoride2-(FLUOROSULFONYL)ANILINEDTXSID50192449NSC-137841NSC 137841RefChem:197674
Show more names
2-azanylbenzenesulfonyl fluoride2-Aminobenzenesulfonic acid fluoride
DTXCID10114940MFCD00007704Benzenesulfonyl fluoride, o-amino-AKOS0243330832-AMINOBENZENE SULFONYL FLUORIDEZ1255485353Benzenesulfonylfluoride, 2-amino-EINECS 206-882-5
Database identifiers
- CAS
392-86-9- PubChem CID
- 97630
- DTXSID
DTXSID50192449- UNII
- 83K4AZ4EUK
- EC Number
- 206-882-5
- Nikkaji
- J213.624D
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 221
Physicochemical properties
- Melting point
- 67 °C · 67 °C
- Boiling point
- 277.6 · 277.6±23.0 °C(Predicted)
- Density
- 1.43 · 1.430±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- -2.41 · -2.41±0.10(Predicted)
- Appearance
- Off-white to light yellow Solid
- FDA UNII
- 83 K4AZ4EUK · 83K4AZ4EUK
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H335-H290-H314
- Precautionary statements
- 260 · P260-P264-P270-P271-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P403+P233-P405-P501
- RIDADR
- 1759 · 1759
- HazardClass
- 8 · 8
- PackingGroup
- III
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- ridadr
- 1759
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- hazard_class
- 8
- packing_group
- III
- Hazard statements
- H302-H335-H290-H314
- Precautionary statements
- P260-P264-P270-P271-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P403+P233-P405-P501
Chemistry & industry
Suppliers17 total
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
西安峥鎏生物科技有限公司15594552852 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
北京珐默兹医药科技有限公司010-80339217; 13331045123 · [email protected]
上海银林医药科技有限公司15000379094 · [email protected]
Aladdin Scientific[email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
杭州陶瑞生物科技有限公司QQ1259737804 15268198094 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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