Basic information
- CAS
1379297-81-0- Standard SMILES
NS(=O)(=O)c1cc(Cl)cc(CCl)c1- InChIKey
YRKXZVFOQWWYLJ-UHFFFAOYSA-N- Molecular formula
- C7H7Cl2NO2S
- Average molar mass
- 240.11 g/mol
- Monoisotopic mass
- 238.957455
Names & identifiers
- Preferred name
- 3-Chloro-5-(chloromethyl)benzene-1-sulfonamide
- IUPAC
- 3-chloro-5-(chloromethyl)benzenesulfonamide
- English name
- 3-Chloro-5-(chloromethyl)benzenesulfonamide
- Molecular formula
- C7H7Cl2NO2S
- Molecular weight
- 240.11
Names & synonyms
1379297-81-03-chloro-5-(chloromethyl)benzene-1-sulfonamideRefChem:500082100-977-43-Chloro-5-(chloromethyl)benzenesulfonamideEFC29781EN300-192784Benzenesulfonamide, 3-chloro-5-(chloromethyl)-
Database identifiers
- CAS
1379297-81-0- PubChem CID
- 91647653
- EC Number
- 100-977-4
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 262
Physicochemical properties
- Boiling point
- 426 · 426.0±55.0 °C(Predicted)
- Density
- 1.519 · 1.519±0.06 g/cm3(Predicted)
- storage temp.
- 0 · Store at 0-8 °C
- pka
- 9.71 · 9.71±0.60(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405
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]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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%)
Safety data
- Signal word
- warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405
Chemistry & industry
Suppliers1 total
常州合晶化工有限公司85528066 13775048983 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…