Pyrrolidine-2-carboxamide
Basic information
- CAS
2812-47-7- Standard SMILES
NC(=O)C1CCCN1- InChIKey
VLJNHYLEOZPXFW-UHFFFAOYSA-N- Molecular formula
- C5H10N2O
- Average molar mass
- 114.15 g/mol
Names & identifiers
- Preferred name
- Pyrrolidine-2-carboxamide
- IUPAC
- pyrrolidine-2-carboxamide
- English name
- H-DL-Pro-NH2
- Molecular formula
- C5H10N2O
- Molecular weight
- 114.15
Names & synonyms
pyrrolidine-2-carboxamideRefChem:871081899-339-22812-47-7dl-prolinamideH-DL-Pro-NH22-pyrrolidinecarboxamide,(s)-MFCD03788250Proline Impurity 3H-DL-Pro-NH HCl58274-20-7h-d-pro-nh
Show more names
2-PYRROLIDINECARBOXAMIDEIFLAB-BB F2124-0727
M02953(+/-)-2-Pyrrolidinecarboxamide; DL-Proline Amide; Pyrrolidine-2-carboxylic Acid Amide;Pyrrolidine-2-carboxylic acid amideDL-Pro-NH2pyrrolidine, 2-carbamoyl-MLS001006873H-DL-Pro-NH2, AldrichCPRSCHEMBL221055
Database identifiers
- CAS
2812-47-7、58274-20-7- PubChem CID
- 550774
- DTXSID
DTXSID20973828- ChEMBL
CHEMBL1599880- EC Number
- 899-339-2
- Nikkaji
- J90.846K
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 103
Experimental & physicochemical properties
Solubility>17.1 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Melting point
- 104 °C · 104 °C
- Boiling point
- 303.6 · 303.6±31.0 °C(Predicted)
- Density
- 1.106 · 1.106
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- form
- solid
- pka
- 16.21 · 16.21±0.20(Predicted)
- Appearance
- White to off-white Solid
- UNSPSC Code
- 12352200 · 12352200
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-41-51
- Safety Statements
- 26 · 26-39
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 ClassificationNot Classified
Hazard information
Hazard Classes and CategoriesNot Classified
Safety data
- risk_code
- 22-41-51
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 26-39
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Chemistry & industry
Applications
UsesH-DL-PRO-NH2 is a proline derivative used in DNA catalysts for the aldol reaction between a porphyrin-bearing aldehyde and a ketone.
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
170 records
Compound notes
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