1,1'-Carbonyldipyrrolidine
Basic information
- CAS
81759-25-3- Standard SMILES
O=C(N1CCCC1)N1CCCC1- InChIKey
HPTQKSXAQBHFKL-UHFFFAOYSA-N- Molecular formula
- C9H16N2O
- Average molar mass
- 168.24 g/mol
- Monoisotopic mass
- 168.12626314
Names & identifiers
- Preferred name
- 1,1'-Carbonyldipyrrolidine
- IUPAC
- dipyrrolidin-1-ylmethanone
- English name
- 1,1'-Carbonyldipyrrolidine
- Molecular formula
- C9H16N2O
- Molecular weight
- 168.24
Names & synonyms
81759-25-31,1'-CARBONYLDIPYRROLIDINEDTXSID20353025RefChem:212341DTXCID30304088621-355-3Di(pyrrolidin-1-yl)methanonedipyrrolidin-1-ylmethanone1-(pyrrolidine-1-carbonyl)pyrrolidineMFCD002166411,1-CarbonyldipyrrolidinePyrrolidine, 1,1'-carbonylbis-
Show more names
CARBODIPIPERIDIDE1,1'-CarbonyldipyrroCARBONYLDIPYRROLIDINEBIS(TETRAMETHYLEN)UREA1,1'-carbonyldipyrolidine1.1'-Carbonyldipyrrolidinebis(1-pyrrolidinyl)methanone
dipyrrolidinyl ketoneditetrahydro-1H-pyrrol-1-ylmethanonecarbonyl dipyrrolidineDi(1-pyrrolidinyl)methanone1,1''-CarbonyldipyrrolidineSCHEMBL4130201,1'-Carbonyldi(pyrrolidine)SCHEMBL3954333
Database identifiers
- CAS
81759-25-3- PubChem CID
- 736440
- DTXSID
DTXSID20353025- EC Number
- 621-355-3
- Nikkaji
- J1.345.776J
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 151
Physicochemical properties
- Boiling point
- 148 · 148-150℃
- Density
- 1.086 g/mL · 1.086 g/mL at 20 °C(lit.)
- refractive index
- 20 · n20/D 1.513
- Flash point
- 113 °C · 113 °C
- storage temp.
- 2 · Storage temp. 2-8°C
- pka
- 0 · -0+-.0.20(Predicted)
- form
- Liquid
- color
- Colorless to pale yellow
- Water Solubility
- Slightly soluble in water.
- Sensitive
- Light Sensitive
- CAS DataBase Reference
- 81759 · 81759-25-3(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- 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
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 39 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
- F
- 8
- wgk
- 3
- hs_code
- 2933998090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Applications
UsesReactant in the ring-opening polymerization of six-and seven-membered cyclic pseudoureas.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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