N,N-Dimethylindoline-5-Sulfonamide
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Basic information
- CAS
99169-99-0- Standard SMILES
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2- InChIKey
RTBHIQIVIFMZDZ-UHFFFAOYSA-N- Molecular formula
- C10H14N2O2S
- Average molar mass
- 226.3 g/mol
- Monoisotopic mass
- 226.07759887
Names & identifiers
- Preferred name
- N,N-Dimethylindoline-5-Sulfonamide
- IUPAC
- N,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide
- English name
- N,N-DIMETHYLINDOLINE-5-SULFONAMIDE
- Molecular formula
- C10H14N2O2S
- Molecular weight
- 226.3
Names & synonyms
N,N-Dimethylindoline-5-Sulfonamide99169-99-0DTXSID00371146RefChem:359387DTXCID70322180677-483-5N,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamideMFCD00214476(indolin-5-ylsulfonyl)dimethylamineN,N-Dimethylindoline-5-sulphonamidePeakdale1_000450SCHEMBL994897
Show more names
AKOS BBS-00002771TIMTEC-BB SBB010224BUTTPARK 120\07-1005-(Dimethylsulfomoyl)indolineN,N-Dimethyl-5-indolinesulfonamideN,N-Dimethylindoline-5-sulphonamide 95+%2,3-DIHYDRO-N,N-DIMETHYL-5-(1H)-INDOLESULFONAMIDE
HMS519E10RTBHIQIVIFMZDZ-UHFFFAOYSA-NHMS5090F05ZDA16999SBB010224STK727280AKOS000118133PS-4902
Database identifiers
- CAS
99169-99-0- PubChem CID
- 2736127
- DTXSID
DTXSID00371146- EC Number
- 677-483-5
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 57.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 321
Physicochemical properties
- Melting point
- 109 · 109-111
- Boiling point
- 389.8 · 389.8±52.0 °C(Predicted)
- Density
- 1.256 · 1.256±0.06 g/cm3(Predicted)
- pka
- 1.83 · 1.83±0.20(Predicted)
- CAS DataBase Reference
- 99169 · 99169-99-0(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 271 · P271-P261-P280
- Hazard Codes
- Xi,T
- Risk Statements
- 25 · 25
- Safety Statements
- 45 · 45
- Hazard Note
- Irritant
- HS Code
- 2935909099 · 2935909099
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 (20%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (20%)
Safety data
- hs_code
- 2935909099
- risk_code
- 25
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,T
- hazard_note
- Irritant
- safety_code
- 45
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P271-P261-P280
Related reactions
2 records
Compound notes
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