Ethylaminobis(1-aziridinyl)phosphine oxide
Basic information
- CAS
302-48-7- Standard SMILES
CCNP(=O)(N1CC1)N1CC1- InChIKey
GQIJAAHMCTVDJP-UHFFFAOYSA-N- Molecular formula
- C6H14N3OP
- Average molar mass
- 175.17 g/mol
- Monoisotopic mass
- 175.08744908
Names & identifiers
- Preferred name
- Ethylaminobis(1-aziridinyl)phosphine oxide
- IUPAC
- N-[bis(aziridin-1-yl)phosphoryl]ethanamine
- English name
- Bis(1-aziridinyl)(ethylamino)phosphine oxide
- Molecular formula
- C6H14N3OP
- Molecular weight
- 175.17
Names & synonyms
302-48-7Phosphinic amide, P,P-bis(1-aziridinyl)-N-ethyl-DTXSID60184294RefChem:1085183DTXCID70106785Ethylaminobis(1-aziridinyl)phosphine oxideP,P-Bis(1-aziridinyl)-N-ethylphosphinic amideENT 50787AI3-50787p,p-bis(aziridin-1-yl)-n-ethylphosphinic amideP,P-Bis(1-aziridinyl)-N-ethylaminophosphine oxideJ7FC9VD9NU
Show more names
ENT-50787Bis(1-aziridinyl)(ethylamino)phosphine oxide
Bis(1-Aziridinyl)-N-ethylphosphinic amide, P,P-
Database identifiers
- CAS
302-48-7- PubChem CID
- 120197
- DTXSID
DTXSID60184294- UNII
- J7FC9VD9NU
- Nikkaji
- J85.540E
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 35.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 184
Physicochemical properties
- Melting point
- 59 °C · 59°C
- Boiling point
- 144 °C · 144 °C(Press: 5 Torr)
- Density
- 1.27 · 1.27±0.1 g/cm3(Predicted)
- pka
- 5.84 · 5.84±0.20(Predicted)
- form
- solid
- Toxicity
- 11 · pic-esc 11,500 mmol/L HEREAY 68,245,71
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- pic-esc 11,500 mmol/L HEREAY 68,245,71
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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