Bis(p-chlorophenoxy)methane
Basic information
- CAS
555-89-5- Standard SMILES
Clc1ccc(OCOc2ccc(Cl)cc2)cc1- InChIKey
COVKSLBAQCJQMS-UHFFFAOYSA-N- Molecular formula
- C13H10Cl2O2
- Average molar mass
- 269.12 g/mol
- Monoisotopic mass
- 268.0057849
Names & identifiers
- Preferred name
- Bis(p-chlorophenoxy)methane
- IUPAC
- 1-chloro-4-[(4-chlorophenoxy)methoxy]benzene
- English name
- Bis-(4-chlorophenoxy)methane
- Molecular formula
- C13H10Cl2O2
- Molecular weight
- 269.12
Names & synonyms
Bis(4-chlorophenoxy)methaneBis(p-chlorophenoxy)methane555-89-5Caswell No. 091Di-(4-chlorophenoxy)methaneDi-p-chlorodiphenoxymethaneMethane, bis(p-chlorophenoxy)-Benzene, 1,1'-(methylenebis(oxy))bis(4-chloro-UNII-11HJA8FF4INSC 6172EINECS 209-107-911HJA8FF4I
Show more names
dcpmoxythanek1875Neotranent15,208CHLORBESIDEDi-p-chlorolphenoxymethanedi-(p-chlorophenoxy)methane
1,1'-(Methylenebis(oxy))bis(4-chloro)benzeneK 1875BRN 1978248AI3-15208NSC-6172DTXSID7041673K-18754-06-00-00833 (Beilstein Handbook Reference)
Database identifiers
- CAS
555-89-5- PubChem CID
- 11155
- DTXSID
DTXSID7041673- UNII
- 11HJA8FF4I
- EC Number
- 209-107-9
- Nikkaji
- J6.476I
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 187
Physicochemical properties
- Melting point
- 70.5 ℃ · 70.5℃
- Boiling point
- 6 · bp6 189-194°
- Density
- 1.3239 · 1.3239 (estimate)
- FDA UNII
- 11 HJA8FF4I · 11HJA8FF4I
- EPA Substance Registry System
- Bis(p-chlorophenoxy)methane (555-89-5)
- Toxicity
- 50 orally · LD50 orally in rats: 5.8 g/kg (Spencer)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- LD50 orally in rats: 5.8 g/kg (Spencer)
Chemistry & industry
Applications
UsesMiticide.
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Compound notes
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