Basic information
- CAS
212189-28-1- Standard SMILES
COC(=O)c1c(F)cccc1[N+](=O)[O-]- InChIKey
MJARIPZQSNWYMM-UHFFFAOYSA-N- Molecular formula
- C8H6FNO4
- Average molar mass
- 199.14 g/mol
- Monoisotopic mass
- 199.02808589
Names & identifiers
- Preferred name
- Methyl 2-fluoro-6-nitrobenzoate
- IUPAC
- methyl 2-fluoro-6-nitrobenzoate
- English name
- 2-Fluoro-6-nitrobenzoic acid methyl ester
- Molecular formula
- C17H15NO
- Molecular weight
- 249.31
Names & synonyms
Methyl 2-fluoro-6-nitrobenzoate212189-28-1DTXSID10344543RefChem:354270DTXCID20295618212189-78-12-Fluoro-6-nitrobenzoic acid methyl esterMFCD09880026methyl 2-fluoro-6-nitro-benzoateBenzenamine,4-[(1-naphthalenyloxy)methyl]-Benzoic acid, 2-fluoro-6-nitro-, methyl esterMethyl2-fluoro-6-nitrobenzoate
Show more names
4-((naphthalen-1-yloxy)methyl)anilineBenzenamine, 4-[(1-naphthalenyloxy)methyl]-
SCHEMBL2061831Methyl 2-fluoro-6-nitrobenzoate #AKOS006311416FD10736CS-16398SY1127372-Fluoro-6-nitro-benzoic acid methyl esterDB-228071
Database identifiers
- CAS
212189-28-1- PubChem CID
- 597752
- DTXSID
DTXSID10344543
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 240
Chemistry & industry
Suppliers1 total
南京凯姆铂医药科技有限公司025-66162170
Related reactions
23 records
Compound notes
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