Completing data — usually done within a minute
Basic information
- CAS
101329-81-1- Standard SMILES
O=[N+]([O-])c1cc(CO)c(Cl)cc1F- InChIKey
MYEUMUCLVULHAU-UHFFFAOYSA-N- Molecular formula
- C7H5ClFNO3
- Average molar mass
- 205.57 g/mol
- Monoisotopic mass
- 204.9941989
Names & identifiers
- Preferred name
- (2-Chloro-4-fluoro-5-nitrophenyl)methanol
- IUPAC
- (2-chloro-4-fluoro-5-nitrophenyl)methanol
Names & synonyms
(2-Chloro-4-fluoro-5-nitrophenyl)methanol101329-81-1SCHEMBL8915124DTXSID40545440MYEUMUCLVULHAU-UHFFFAOYSA-NG620792-CHLORO-4-FLUORO-5-NITROBENZYL ALCOHOL
Database identifiers
- CAS
101329-81-1- PubChem CID
- 13629752
- DTXSID
DTXSID40545440
Properties
Computed structural propertiesFilling in
- XLogP
- 1.6
- Topological polar surface area
- 66.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 199
Related reactions
4 records
Compound notes
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