Basic information
- Standard SMILES
CN(C)S(=O)(=O)Cl- InChIKey
JFCHSQDLLFJHOA-UHFFFAOYSA-N- Molecular formula
- C2H6ClNO2S
- Average molar mass
- 143.59 g/mol
- Monoisotopic mass
- 142.98077711
Names & identifiers
- Preferred name
- Dimethylsulphamoyl chloride
- IUPAC
- N,N-dimethylsulfamoyl chloride
- English name
- Dimethylsulfamoyl chloride
- Molecular formula
- C2H6ClNO2S
- Molecular weight
- 143.59
Names & synonyms
Dimethylsulfamoyl chloride13360-57-1Sulfamoyl chloride, dimethyl-Dimethylaminosulfonyl chlorideDimethylsulfamoylchlorideDimethylsulphamoyl chlorideDimethylamidosulfonyl chlorideN,N-Dimethylsulfamyl chlorideSulfamoyl chloride, N,N-dimethyl-EINECS 236-412-4NSC 93875BRN 0741979
Show more names
N,N-DIMETHYLSULFAMOYL CHLORIDEDimethylsulfamoylfamoyLDiMethylsulfaMoy ChlorideDimethylsdulfamoylchloriddimethyl-sulfamoylchloridDimethylsulfamyl chlorideDIMETHYLAMINOSULFOCHLORIDESulfamoylchloride,dimethyl-
4-04-00-00270 (Beilstein Handbook Reference)DTXSID6065420EC 236-412-4RefChem:588614sulfamoyl chloride, dimethylN,NDimethylsulfamyl chlorideN,NDimethylsulfamoyl chlorideSulfamoyl chloride, N,Ndimethyl
Database identifiers
- CAS
13360-57-1- PubChem CID
- 83372
- DTXSID
DTXSID6065420- UNII
- 76BN2B689B
- EC Number
- 236-412-4
- Nikkaji
- J23.438I
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 132
Experimental & physicochemical properties
Chemical ClassesToxic Gases & Vapors -> Acid Halides
SpringerMaterials Properties15N nuclear magnetic resonance spectrum
Physical DescriptionClear colorless liquid; [MSDSonline]
Physicochemical properties
- Melting point
- -13 °C · -13 °C
- Boiling point
- 114 °C75 · 114 °C75 mm Hg(lit.)
- Density
- 1.337 g/mL · 1.337 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.452(lit.)
- Flash point
- 202 °F · 202 °F
- storage temp.
- 2 · Inert atmosphere,2-8°C
- solubility
- Chloroform, Ethyl Acetate (Slightly)
- pka
- -8.25 · -8.25±0.70(Predicted)
- form
- Oil
- color
- Colourless to Off-White
- Water Solubility
- DECOMPOSES
- BRN
- 741979 · 741979
- Stability
- Moisture Sensitive
- InChIKey
- JFCHSQDLLFJHOA-UHFFFAOYSA-N
- CAS DataBase Reference
- 13360 · 13360-57-1(CAS DataBase Reference)
- FDA UNII
- 76 BN2B689B · 76BN2B689B
- EPA Substance Registry System
- Sulfamoyl chloride, dimethyl- (13360-57-1)
- Symbol(GHS)
- 5 · GHS05,GHS06,GHS08
- Signal word
- Danger
- Hazard statements
- 302 · H302+H312-H314-H330-H350
- Precautionary statements
- 201 · P201-P280-P301+P312+P330-P303+P361+P353-P304+P340+P310-P305+P351+P338+P310
- Hazard Codes
- T+
- Risk Statements
- 45 · 45-21/22-26-34
- Safety Statements
- 53 · 53-45
- RIDADR
- 3390 · UN 3390 6.1/PG 1
- WGK Germany
- 3 · 3
- RTECS
- 7185500 · WO7185500
- F
- 10 · 10
- TSCA
- TSCA listed
- HazardClass
- 6.1 · 6.1(a)
- PackingGroup
- III
- HS Code
- 29299000 · 29299000
- Toxicity
- 300 mg/m3/10M · mouse,LC,inhalation,> 300mg/m3/10M (300mg/m3),National Defense Research Committee, Office of Scientific Research and Development, Progress Report.Vol. NDCrc-132, Pg. Nov, 1942.
- REACH Registrations
- Active
- Limited Quantities
- 100 ml · 100ml (liquid) or 0.5 Kg (solid)
- Excepted Quantities
- Max Inner Pack (1g or 1ml) and Max Outer Pack (500g or 500ml)
Safety & regulation
GHS classification
GHS Classification
Danger
H302: Harmful if swallowed [Warning Acute toxicity, oral]
P203, P260, P264, P270, P271, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P318, P320, P321, P330, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P260, P262, P264, P264+P265, P270, P271, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P318, P320, P321, P330, P361+P364, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
Hazard information
Regulatory Information
Hazard Traits - Carcinogenicity
Status: Active Update: 16-03-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/1978
Dimethylsulphamoyl chloride: Does not have an individual approval but may be used under an appropriate group standard
Hazards Summary
Harmful by ingestion and skin absorption; Highly toxic by inhalation; May cause burns; [eChemPortal: ESIS] Danger of cutaneous absorption; MAC-2 (considered to be carcinogenic for man because sufficient data from long-term animal studies or limited evidence from animal studies substantiated by evidence from epidemiological studies indicate that it can make a significant contribution to cancer risk); [MAK] May decompose on exposure to moisture; A corrosive substance that can cause injury to the skin, eyes, and respiratory tract; Inhalation may cause chemical pneumonitis and pulmonary edema; [MSDSonline]
Hazard Classes and Categories
Acute Tox. 4 (100%)
Carcinogenicity - category 1B
Flammable liquids - Category 4
Acute toxicity (Oral) - Category 4
Carc. 1B
Safety & protection
Exposure Control and Personal Protection
TIH (Toxic Inhalation Hazard) - Term used to describe gases and volatile liquids that are toxic when inhaled. Some are TIH materials themselves, e.g., chlorine, and some release TIH gases when spilled in water, e.g., chlorosilanes. [ERG 2016].
Toxicology
Adverse EffectsDermatotoxin - Skin burns.
Toxicity DataLC (mice) > 300 mg/m3/10min
Safety data
- F
- 10
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- WO7185500
- ridadr
- UN 3390 6.1/PG 1
- hs_code
- 29299000
- Toxicity
- mouse,LC,inhalation,> 300mg/m3/10M (300mg/m3),National Defense Research Committee, Office of Scientific Research and Development, Progress Report.Vol. NDCrc-132, Pg. Nov, 1942.
- risk_code
- 45-21/22-26-34
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS06,GHS08
- hazard_code
- T+
- safety_code
- 53-45
- hazard_class
- 6.1(a)
- packing_group
- III
- Hazard statements
- H302+H312-H314-H330-H350
- Limited Quantities
- 100ml (liquid) or 0.5 Kg (solid)
- Excepted Quantities
- Max Inner Pack (1g or 1ml) and Max Outer Pack (500g or 500ml)
- REACH Registrations
- Active
- Precautionary statements
- P201-P280-P301+P312+P330-P303+P361+P353-P304+P340+P310-P305+P351+P338+P310
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationSulfamoyl chloride, N,N-dimethyl-: ACTIVE
Applications
UsesDichlorofluanid is a degradation product of the pesticide Dichlorofluanid.
Upstream & downstream products
Upstream raw materials
Downstream products
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