Basic information
- CAS
93778-18-8- Standard SMILES
CS(=O)(=O)c1ccc(Sc2ccccc2[N+](=O)[O-])c(NC=O)c1- InChIKey
YTQRRMOEFNDDTC-UHFFFAOYSA-N- Molecular formula
- C14H12N2O5S2
- Average molar mass
- 352.4 g/mol
- Monoisotopic mass
- 352.01876383
Names & identifiers
- Preferred name
- N-(5-(methylsulphonyl)-2-((2-nitrophenyl)thio)phenyl)formamide
- IUPAC
- N-[5-methylsulfonyl-2-(2-nitrophenyl)sulfanylphenyl]formamide
- English name
- N-[5-(methylsulphonyl)-2-[(2-nitrophenyl)thio]phenyl]formamide
- Molecular formula
- C14H12N2O5S2
- Molecular weight
- 352.38548
Names & synonyms
93778-18-8EINECS 298-152-8N-(5-(Methylsulphonyl)-2-((2-nitrophenyl)thio)phenyl)formamideDTXSID10239627N-[5-(METHYLSULFONYL)-2-[(2-NITROPHENYL)THIO]PHENYL]FORMAMIDEN-(5-(Methylsulfonyl)-2-((2-nitrophenyl)thio)phenyl)formamideN-[5-(METHYLSULPHONYL)-2-[(2-NITROPHENYL)THIO]PHENYL]FORMAMIDERefChem:828017DTXCID60162118298-152-85V8H5VH6ZBYTQRRMOEFNDDTC-UHFFFAOYSA-N
Show more names
NS00039612Formamide, N-[5-(methylsulfonyl)-2-[(2-nitrophenyl)thio]phenyl]-N-{5-(Methanesulfonyl)-2-[(2-nitrophenyl)sulfanyl]phenyl}formamide
Database identifiers
- CAS
93778-18-8- PubChem CID
- 3022326
- DTXSID
DTXSID10239627- UNII
- 5V8H5VH6ZB
- EC Number
- 298-152-8
- Nikkaji
- J348.731H
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 143 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 528
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H332-H302-H317-H312
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P280-P302+P352-P312-P322-P363-P501-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
- REACH Registrations
- Active
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, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P333+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationREACH registered substance: N-[5-(methylsulphonyl)-2-[(2-nitrophenyl)thio]phenyl]formamide (EC: 298-152-8)
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H332-H302-H317-H312
- REACH Registrations
- Active
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P280-P302+P352-P312-P322-P363-P501-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
Chemistry & industry
Suppliers1 total
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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