Basic information
- CAS
326023-07-8- Standard SMILES
Nc1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1N- InChIKey
AOGHWVVQPRDCSU-UHFFFAOYSA-N- Molecular formula
- C12H12ClN3O2S
- Average molar mass
- 297.76 g/mol
- Monoisotopic mass
- 297.0338755
Names & identifiers
- Preferred name
- 3,4-diamino-N-(2-chlorophenyl)benzenesulfonamide
- IUPAC
- 3,4-diamino-N-(2-chlorophenyl)benzenesulfonamide
- English name
- 3,4-Diamino-N-(2-chloro-phenyl)-benzenesulfonamide
- Molecular formula
- C12H12ClN3O2S
- Molecular weight
- 297.76
Names & synonyms
3,4-diamino-N-(2-chlorophenyl)benzenesulfonamide326023-07-83,4-Diamino-N-(2-chloro-phenyl)-benzenesulfonamide3,4-diamino-N-(2-chlorophenyl)benzene-1-sulfonamideMFCD02700611SCHEMBL1069465AOGHWVVQPRDCSU-UHFFFAOYSA-NSBB042477AKOS000115589SB82609SY138861CS-0451063
Show more names
AKOS BBS-00006432Benzenesulfonamide, 3,4-diamino-N-(2-chlorophenyl)-
EN300-02089G42925F772892SR-01000027745[(3,4-diaminophenyl)sulfonyl](2-chlorophenyl)amineSR-01000027745-1Z56779182
Database identifiers
- CAS
326023-07-8- PubChem CID
- 3766596
- EC Number
- 173-403-3
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 398
Physicochemical properties
- Boiling point
- 519.4 · 519.4±60.0 °C(Predicted)
- Density
- 1.526 · 1.526±0.06 g/cm3(Predicted)
- pka
- 8.86 · 8.86±0.10(Predicted)
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, 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%)
Chemistry & industry
Suppliers4 total
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
上海研邦医药科技有限公司15618536883 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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