Basic information
- CAS
1224-64-2- Standard SMILES
CCCCP(=O)(CCCC)Oc1ccc([N+](=O)[O-])cc1- InChIKey
MQOMKCIKNDDXEZ-UHFFFAOYSA-N- Molecular formula
- C14H22NO4P
- Average molar mass
- 299.3 g/mol
- Monoisotopic mass
- 299.12864518
Overview
structure
Names & identifiers
- Preferred name
- 4-Nitrophenyl P,P-dibutylphosphinate
- IUPAC
- 1-dibutylphosphoryloxy-4-nitrobenzene
- English name
- nibufin
- Molecular formula
- C14H22NO4P
- Molecular weight
- 299.305
Names & synonyms
Nibufin1224-64-2DTXSID70153592P-nitrophenyl di-N-butylphosphinate4-nitrophenyl dibutylphosphinic acidP-nitrophenyl dibutylphosphinic acidRefChem:912728DTXCID60760834-Nitrophenyl P,P-dibutylphosphinatedibutylphosphinic acid, 4-nitrophenyl esterNibuphinTarin
Show more names
p-Nitrophenyldibutylphosphinatep-Nitrophenyldi-n-butylphosphinateBRN 25093644-nitrophenyl dibutylphosphinateDibutyl-phosphinic acid, 4-nitrophenyl esterPhosphinic acid, dibutyl-, p-nitrophenyl esterp-Nitropenylester kyseliny dibutylfosfinove [Czech]p-Nitropenylester kyseliny dibutylfosfinove
Database identifiers
- CAS
1224-64-2- PubChem CID
- 71041
- DTXSID
DTXSID70153592- Nikkaji
- J7.464K
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 323
Physicochemical properties
- Boiling point
- 209.1 °C · 209.1°C
- Toxicity
- 50 ipr-rat: · LD50 ipr-rat: 12,300 mg/kg TXAPA9 49,23,79
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
- LD50 ipr-rat: 12,300 mg/kg TXAPA9 49,23,79
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers1 total
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…