Basic information
- CAS
14891-10-2- Standard SMILES
CCOC(=O)N1CCC(=O)C1- InChIKey
DQYGBMLEVQLDQC-UHFFFAOYSA-N- Molecular formula
- C7H11NO3
- Average molar mass
- 157.17 g/mol
- Monoisotopic mass
- 157.07389321
Names & identifiers
- Preferred name
- Ethyl 3-oxopyrrolidine-1-carboxylate
- IUPAC
- ethyl 3-oxopyrrolidine-1-carboxylate
- English name
- 1-N-Ethoxycarbonyl-3-pyrrolidone
- Molecular formula
- C7H11NO3
- Molecular weight
- 157.17
Names & synonyms
ethyl 3-oxopyrrolidine-1-carboxylateDTXSID00298884RefChem:595071DTXCID80250021672-370-714891-10-21-N-Ethoxycarbonyl-3-pyrrolidoneMFCD020938401-PYRROLIDINECARBOXYLIC ACID, 3-OXO-, ETHYL ESTER3-oxo-pyrrolidine-1-carboxylic acid ethyl ester1-ETHOXYCARBONYL-3-PYRROLIDINONEethyl 3-oxo-1-pyrrolidinecarboxylate
Show more names
1-Boc-3-OxopyrrolidineEthyl 3-oxopyrrolidine-1-...1-Ethoxycabonyl-3-PyrrolidoneN-(Ethoxy carboNyl)-3-pyrrolidoNeEthyl 1-ethoxycarbonylpyrrolidin-3-one
1-Ethoxycarbonyl-3-pyrrolidoneNSC126739ethoxycarbonyl-3-pyrrolidoneSCHEMBL5688181-ethoxycarbonylpyrrolidin-3-one1-ethoxycarbonyl-pyrrolidin-3-oneDQYGBMLEVQLDQC-UHFFFAOYSA-NCS-B0610
Database identifiers
- CAS
14891-10-2- PubChem CID
- 277754
- DTXSID
DTXSID00298884- EC Number
- 672-370-7
- Nikkaji
- J1.264.318G
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 179
Physicochemical properties
- Boiling point
- 122 · 122-132 °C(Press: 12 Torr)
- Density
- 1.205 · 1.205±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C, · -20°C, sealed storage, away from moisture
- pka
- -1.79 · -1.79±0.20(Predicted)
- Appearance
- Colorless to light yellow Liquid
- CAS DataBase Reference
- 14891 · 14891-10-2(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H315-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- Hazard Codes
- Xn
- Risk Statements
- 36 · 36/37/38-36-22
- Safety Statements
- 26 · 26-36/37/39
- HazardClass
- IRRITANT
- HS Code
- 2933998090 · 2933998090
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2933998090
- risk_code
- 36/37/38-36-22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 26-36/37/39
- hazard_class
- IRRITANT
- Hazard statements
- H319-H315-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Applications
Uses1-N-Ethoxycarbonyl-3-pyrrolidone can be used as a pharmaceutical intermediate.
Upstream & downstream products
Upstream raw materials
Suppliers70 total
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海弘顺生物科技有限公司15901914505 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
成都福尔斯特医药技术有限公司028-87078428 028-87074958 · [email protected]
杭州东帆化学有限公司86-0571-85151182
常州宣叶科技有限公司15195022192 · [email protected]
江阴安博生物医药有限公司086-010-62176588 · [email protected]
成都海品信医药科技有限公司85114309 18982182443 · [email protected]
陕西麟邦实业有限公司17709134430 · [email protected]
上海熙誉化学科技有限公司021-15000143735 15221126179 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
Qingdao Dexin Chemical Co., Ltd+86-15553333686 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
上海拓目化工有限公司13391076197 · [email protected]
青岛海智微元生物科技有限公司18317699790 18317699790 · [email protected]
成都赛诺宁科技有限公司28-87999436 02887999436 · [email protected]
斯派螺（武汉）药物研发有限公司[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
嘉兴市德亿化工有限公司0573-85866609 13325730825 · [email protected]
北京汇科盈生物科技有限公司15210661751 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
上海岚克医药科技发展有限公司0086-21-58956006
上海源叶生物科技有限公司13636370518 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
上海修时生物医药有限公司15002184385 15021598081 15002184385 · [email protected]
泰安市嘉叶生物科技有限公司15318151873;13127280945 · [email protected]
上海特伯化学科技有限公司021-58170097 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
山东小野化学股份有限公司0539-6362799 20）
杭州摩库生物医药科技有限公司400-711-5280 86-571-81025280 · [email protected]
苏州昊帆生物股份有限公司0512-68311833 13962195826 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
Capot Chemical Co.,Ltd.+86-（0）57185586718 +86-13336195806 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
武汉赢元贝商贸有限公司86-13349903920 13349903920 · [email protected]
爱诗伦生物科技（上海）有限公司021-50676523 18019098996 · [email protected]
海蔚化学86-21-51086038 · [email protected]
Aladdin Scientific[email protected]
Related reactions
16 records
Compound notes
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