Morpholine-3-carboxamide
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Basic information
- CAS
848488-74-4- Standard SMILES
NC(=O)C1COCCN1- InChIKey
YPSPPJRTCRMQGD-UHFFFAOYSA-N- Molecular formula
- C5H10N2O2
- Average molar mass
- 130.15 g/mol
- Monoisotopic mass
- 130.07422757
Names & identifiers
- Preferred name
- Morpholine-3-carboxamide
- IUPAC
- morpholine-3-carboxamide
- English name
- Morpholine-3-carboxylic acid amide
- Molecular formula
- C5H10N2O2
- Molecular weight
- 130.15
Names & synonyms
morpholine-3-carboxamide848488-74-4RefChem:819507841-865-1Morpholine-3-carboxylic acid amide3-MorpholinecarboxamideMFCD12406987SCHEMBL1317533SCHEMBL2439644SCHEMBL3563676YPSPPJRTCRMQGD-UHFFFAOYSA-NYIB48874
Show more names
AKOS006340095CCG-211498SB39000AS-48062DA-17434CS-0225595EN300-124383F17613
Database identifiers
- CAS
848488-74-4- PubChem CID
- 19792002
- EC Number
- 841-865-1
Properties
Computed structural propertiesFilling in
- XLogP
- -1.6
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 116
Physicochemical properties
- Boiling point
- 350 · 350.0±37.0 °C(Predicted)
- Density
- 1.162 · 1.162±0.06 g/cm3(Predicted)
- pka
- 16.36 · 16.36±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 318 · H318-H315-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H318-H315-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
Chemistry & industry
Applications
Uses3-Morpholinecarboxamide is derived from 3-Morpholinecarbonitrile (M723800), which is used as a reactant in the synthesis of N-methyl pyrimidone derivatives as potent and orally bioavailable HIV integrase inhibitors.
Related reactions
9 records
Compound notes
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