Basic information
- CAS
145430-08-6- Standard SMILES
CC(C)CCOC(=O)NC(C(F)(F)F)(C(F)(F)F)P(=O)(c1ccccc1)c1ccccc1- InChIKey
RXYZJSFQYLLONF-UHFFFAOYSA-N- Molecular formula
- C21H22F6NO3P
- Average molar mass
- 481.4 g/mol
- Monoisotopic mass
- 481.12414953
Names & identifiers
- Preferred name
- Carbamic acid, (1-(diphenylphosphinyl)-2,2,2-trifluoro-1-(trifluoromethyl)ethyl)-, 3-methylbutyl ester
- IUPAC
- 3-methylbutyl N-(2-diphenylphosphoryl-1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate
- English name
- 3-methylbutyl N-(2-diphenylphosphoryl-1,1,1,3,3,3-hexafluoro-propan-2- yl)carbamate
- Molecular formula
- C21H22F6NO3P
- Molecular weight
- 481.37
Names & synonyms
145430-08-6DTXSID90163017Carbamic acid, (1-(diphenylphosphinyl)-2,2,2-trifluoro-1-(trifluoromethyl)ethyl)-, 3-methylbutyl esterRefChem:331765DTXCID3085508Isopentyl (2-(diphenylphosphoryl)-1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate3-methylbutyl N-(2-diphenylphosphoryl-1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate3-METHYLBUTYL N-(2-DIPHENYLPHOSPHORYL-1,1,1,3,3,3-HEXAFLUORO-PROPAN-2- YL)CARBAMATE3-Methylbutyl (1-(diphenylphosphinyl)-2,2,2-trifluoro-1-(trifluoromethyl)ethyl)carbamate3-Methylbutyl [2-(diphenylphosphoryl)-1,1,1,3,3,3-hexafluoropropan-2-yl]carbamateCarbamic acid, N-[1-(diphenylphosphinyl)-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-, 3-methylbutyl esterCarbamic acid, [1-(diphenylphosphinyl)-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-, 3-methylbutyl ester (9CI)
Database identifiers
- CAS
145430-08-6- PubChem CID
- 3073006
- DTXSID
DTXSID90163017
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 631
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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