Basic information
- CAS
4242-30-2- Standard SMILES
O=C(Cc1ccc([N+](=O)[O-])cc1)OCCF- InChIKey
GTCNCFMJBMQOJT-UHFFFAOYSA-N- Molecular formula
- C10H10FNO4
- Average molar mass
- 227.19 g/mol
- Monoisotopic mass
- 227.05938596
Names & identifiers
- Preferred name
- Acetic acid, (p-nitrophenyl)-, 2-fluoroethyl ester
- IUPAC
- 2-fluoroethyl 2-(4-nitrophenyl)acetate
Names & synonyms
2-Fluoroethyl (4-nitrophenyl)acetate4242-30-2(p-Nitrophenyl)acetic acid 2-fluoroethyl esterBRN 2979805ACETIC ACID, (p-NITROPHENYL)-, 2-FLUOROETHYL ESTERDTXSID90195212RefChem:316345DTXCID00117703
Database identifiers
- CAS
4242-30-2- PubChem CID
- 20232
- DTXSID
DTXSID90195212
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 246
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…