Ethyl pyrrolidine-2-carboxylate
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Basic information
- CAS
60169-67-7- Standard SMILES
CCOC(=O)C1CCCN1- InChIKey
QPNJHVDIRZNKOX-UHFFFAOYSA-N- Molecular formula
- C7H13NO2
- Average molar mass
- 143.18 g/mol
- Monoisotopic mass
- 143.09462866
Names & identifiers
- Preferred name
- Ethyl pyrrolidine-2-carboxylate
- IUPAC
- ethyl pyrrolidine-2-carboxylate
- English name
- Ethyl pyrrolidine-2-carboxylate
- Molecular formula
- C7H13NO2
- Molecular weight
- 143.18
Names & synonyms
ethyl pyrrolidine-2-carboxylate60169-67-7DTXSID70338685RefChem:345003DTXCID10289768850-828-9MFCD00126468ethyl prolinatedl-proline ethyl esterethylpyrrolidine-2-carboxylateSCHEMBL115996SCHEMBL1049438
Show more names
D/L-Proline Ethyl EsterDL-Proline ethyl ester HCl
SCHEMBL1387807QPNJHVDIRZNKOX-UHFFFAOYSA-NKCA16967AKOS008118629DB-019596CS-0248747EN300-41250Z361885340
Database identifiers
- CAS
60169-67-7- PubChem CID
- 550673
- DTXSID
DTXSID70338685- EC Number
- 850-828-9
Properties
Computed structural propertiesFilling in
- XLogP
- 0.5
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 125
Physicochemical properties
- Melting point
- 176 °C · 176 °C
- Boiling point
- 78 · 78-79 °C(Press: 10-11 Torr)
- Density
- 1.031 · 1.031±0.06 g/cm3(Predicted)
- pka
- 8.23 · 8.23±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 302 · H302-H318-H315-H335
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
- HS Code
- 2933998090 · 2933998090
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2933998090
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H302-H318-H315-H335
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
13 records
Compound notes
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