1-(2-Aminoethyl)pyrrolidin-2-one
Basic information
- CAS
24935-08-8- Standard SMILES
NCCN1CCCC1=O- InChIKey
HHEKNWQXFVOUNJ-UHFFFAOYSA-N- Molecular formula
- C6H12N2O
- Average molar mass
- 128.17 g/mol
- Monoisotopic mass
- 128.094963
Names & identifiers
- Preferred name
- 1-(2-Aminoethyl)pyrrolidin-2-one
- IUPAC
- 1-(2-aminoethyl)pyrrolidin-2-one
- English name
- 1-(2-aminoethyl)pyrrolidin-2-one
- Molecular formula
- C6H12N2O
- Molecular weight
- 128.17
Names & synonyms
1-(2-Aminoethyl)pyrrolidin-2-one24935-08-81-(2-aminoethyl)-2-pyrrolidinoneN-(2-Aminoethyl)-2-pyrrolidone5LR8N9FTE7EINECS 246-539-7DTXSID90179653RefChem:421505DTXCID50102144246-539-71-(2-Amino-ethyl)-pyrrolidin-2-oneMFCD01822267
Show more names
1-(2-aminoethyl)-2-pyrrolidoneN-(2-Aminoethyl)pyrrolidin-2-one2-Pyrrolidinone,1-(2-aMinoethyl)-N-(beta-Aminoethyl)-2-pyrrolidinone[2-(2-Oxopyrrolidin-1-yl)ethyl]amine1-(2-Aminoethyl)-2-pyrrolidinone hydrochloride1-(2-Aminoethyl)pyrrolidin-2-one HCL Form, 97%min
2-Pyrrolidinone, 1-(2-aminoethyl)-1-(2-aminoethyl)-pyrrolidin-2-one1-(2-Aminoethyl)-2-pyrrolidinone HClaminoethylpyrrolidoneUNII-5LR8N9FTE7SCHEMBL34585SCHEMBL509948N-(2-aminoethyl)-pyrrolidinone
Database identifiers
- CAS
24935-08-8- PubChem CID
- 90660
- DTXSID
DTXSID90179653- UNII
- 5LR8N9FTE7
- EC Number
- 246-539-7
- Nikkaji
- J286.429K
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 114
Physicochemical properties
- Boiling point
- 125 · 125-130℃ (0.5 Torr)
- Density
- 1.09 · 1.090±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- solubility
- Chloroform (Soluble), Methanol (Slightly)
- pka
- 9.04 · 9.04±0.10(Predicted)
- form
- Oil
- color
- Colourless to Light Brown
- FDA UNII
- 5 LR8N9FTE7 · 5LR8N9FTE7
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26
- RIDADR
- 2735 · UN2735
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 40 reports by companies from 3 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
- wgk
- 3
- ridadr
- UN2735
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Limited Quantities
- 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
- Precautionary statements
- P261-P305+P351+P338
Related reactions
16 records
Compound notes
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