Basic information
- CAS
105-35-1- Standard SMILES
CCNC(=O)CCl- InChIKey
JUBORNFANZZVJL-UHFFFAOYSA-N- Molecular formula
- C4H8ClNO
- Average molar mass
- 121.56 g/mol
- Monoisotopic mass
- 121.0294416
Names & identifiers
- Preferred name
- 2-chloro-N-ethylacetamide
- IUPAC
- 2-chloro-N-ethylacetamide
- English name
- 2-Chloro-N-ethylacetamide
- Molecular formula
- C4H8ClNO
- Molecular weight
- 121.57
Names & synonyms
2-Chloro-N-ethylacetamide105-35-1Acetamide, 2-chloro-N-ethyl-N-Ethyl-2-chloroacetamideN-Ethylchloroacetamide5R32RJ2V2ANSC-1192EINECS 203-289-3(N-Chloroacetyl)ethyl amineDTXSID30146905NSC 1192RefChem:86426
Show more names
TIMTEC-BB SBB0082002-chloro-N-ethyl-ethanamide.alpha.-Chloro-N-ethylacetamide
DTXCID9069396203-289-3JUBORNFANZZVJL-UHFFFAOYSA-N2-chloro-N-ethyl-acetamideMFCD00040868NSC1192N-ethylmonochloroacetamide2-chloro-N-ethyl acetamide
Database identifiers
- CAS
105-35-1- PubChem CID
- 66044
- DTXSID
DTXSID30146905- UNII
- 5R32RJ2V2A
- EC Number
- 203-289-3
- Nikkaji
- J182.195D
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 64.7
Physicochemical properties
- Melting point
- 129 °C · 129 °C(Solv: benzene (71-43-2))
- Boiling point
- 96 °C · 96 °C(Press: 13 Torr)
- Density
- 1.086 · 1.086±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- form
- solid
- pka
- 14.39 · 14.39±0.46(Predicted)
- InChI
- InChI=1S/C4H8ClNO/c1-2-6-4(7)3-5/h2-3H2,1H3,(H,6,7)
- InChIKey
- JUBORNFANZZVJL-UHFFFAOYSA-N
- SMILES
- C(NCC)(=O)CCl
- FDA UNII
- 5 R32RJ2V2A · 5R32RJ2V2A
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301
- Precautionary statements
- 301 · P301+P310
- Hazard Codes
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
H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]
P260, P261, P264, P270, P271, P280, P301+P316, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 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. 3 (50%)
Safety data
- wgk
- WGK 3
- ridadr
- UN 2811 6.1 / PGIII
- hs_code
- 2924297099
- risk_code
- 36/37/38-25
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- hazard_code
- T
- safety_code
- 26-36/37/39-45
- Storage Class
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard statements
- H301
- Hazard Classifications
- Acute Tox. 3 Oral
- Precautionary statements
- P301+P310
Chemistry & industry
Applications
Uses2-Chloro-N-ethylacetamide is an amide compound. It can be used to synthesise other organic heterocyclic compounds such as 2-(diphenylphosphoryl)-N-ethylacetamide and N-ethylcarbamoylmethyl 2-[3-(trifluoromethyl)anilino]nicotinic ester.
Suppliers36 total
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Hubei Lidu New Material Technology Co., Ltd+86-19307248857 +86-19307248857 · [email protected]
衢州明锋化工有限公司0570-3062502 13819002126;13819008176 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
ChemeGen 中国18818260767 · [email protected]
南京维奥化工有限公司Please Send Email 18652950785 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
陕西麟邦实业有限公司
Related reactions
12 records
Compound notes
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