Acetic acid, ((3,5-dichloro-2-pyridyl)oxy)-
Basic information
- CAS
68057-86-3- Standard SMILES
O=C(O)COc1cc(Cl)cc(Cl)n1- InChIKey
MPSIVEQXRHPLDX-UHFFFAOYSA-N- Molecular formula
- C7H5Cl2NO3
- Average molar mass
- 222.02 g/mol
- Monoisotopic mass
- 220.9646484
Names & identifiers
- Preferred name
- Acetic acid, ((3,5-dichloro-2-pyridyl)oxy)-
- IUPAC
- 2-[(4,6-dichloro-2-pyridinyl)oxy]acetic acid
- English name
- [(3,5-Dichloro-2-pyridinyl)oxy]acetic acid
- Molecular formula
- C7H5Cl2NO3
- Molecular weight
- 222.03
Names & synonyms
BRN 0188606ACETIC ACID, ((3,5-DICHLORO-2-PYRIDYL)OXY)-4-21-00-00361 (Beilstein Handbook Reference)RefChem:31592868057-86-3DTXSID10987499[(4,6-Dichloropyridin-2-yl)oxy]acetic acid[(3,5-Dichloro-2-pyridinyl)oxy]acetic acidAcetic acid, 2-[(3,5-dichloro-2-pyridinyl)oxy]-
Database identifiers
- CAS
68057-86-3- PubChem CID
- 50030
- DTXSID
DTXSID10987499- EC Number
- 174-719-4
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 191
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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