Basic information
- CAS
64037-31-6- Standard SMILES
O=c1[nH]c2c(Cl)c(Cl)cc(Cl)c2o1- InChIKey
DEUSSOTUEGORRC-UHFFFAOYSA-N- Molecular formula
- C7H2Cl3NO2
- Average molar mass
- 238.5 g/mol
- Monoisotopic mass
- 236.915111
Names & identifiers
- Preferred name
- 2-Benzoxazolinone, 4,5,7-trichloro-
- IUPAC
- 4,5,7-trichloro-3H-1,3-benzoxazol-2-one
Names & synonyms
64037-31-62-BENZOXAZOLINONE, 4,5,7-TRICHLORO-4,5,7-Trichloro-2-benzoxazolinoneDTXSID10214050NSC 25000RefChem:256426DTXCID10136541NSC25000SCHEMBL2149923NSC-250002(3H)-Benzoxazolone,5,7-trichloro-AKOS011654966
Show more names
4,5,7-Trichloro-2(3h)-benzoxazoloneDB-1948184,5,7-Trichloro-1,3-benzoxazol-2(3H)-one
Database identifiers
- CAS
64037-31-6- PubChem CID
- 46405
- DTXSID
DTXSID10214050- Nikkaji
- J67.941K
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 238
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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