5-Hydroxydicamba
Basic information
- CAS
7600-50-2- Standard SMILES
COc1c(Cl)cc(O)c(Cl)c1C(=O)O- InChIKey
XYHBJALHMANCCC-UHFFFAOYSA-N- Molecular formula
- C8H6Cl2O4
- Average molar mass
- 237.03 g/mol
- Monoisotopic mass
- 235.9643141
Names & identifiers
- Preferred name
- 5-Hydroxydicamba
- IUPAC
- 2,5-dichloro-3-hydroxy-6-methoxybenzoic acid
- English name
- 2,5-Dichloro-3-hydroxy-6-methoxybenzoic acid
- Molecular formula
- C8H6Cl2O4
- Molecular weight
- 237.04
Names & synonyms
7600-50-25-HydroxydicambaBenzoic acid, 2,5-dichloro-3-hydroxy-6-methoxy-o-Anisic acid, 3,6-dichloro-5-hydroxy-UNII-21U43KQY7J21U43KQY7J3,6-dichloro-5-hydroxy-o-anisic acidHYDROXYDICAMBA, 5-DTXSID80415395-HYDROXY-3,6-DICHLORO-O-ANISIC ACIDRefChem:102869DTXCID6021539
Show more names
C12260500 Dicamba-5-hydroxy100ug/mlinAcetone:Water(90:10)Dicamba-5-hydroxy 100 μg/mL in AcetonitrileXA12260500ALDicamba-5-hydroxy 100μg/mLin AcetDicamba-5-hydroxy, 100 μg /μL in Acetonitrile
XYHBJALHMANCCC-UHFFFAOYSA-N2,5-Dichloro-3-hydroxy-6-methoxybenzoic acidDicamba-5-hydroxy2,5-Dichloro-3-hydroxy-6-methoxybenzoicacid5-OH-DicambaSCHEMBL3764880HAA60050MSK22530
Database identifiers
- CAS
7600-50-2- PubChem CID
- 82075
- DTXSID
DTXSID8041539- UNII
- 21U43KQY7J
- EC Number
- 690-361-6
- Nikkaji
- J124.918E
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 223
Experimental & physicochemical properties
SpringerMaterials PropertiesFusion temperature
PesticidesEnvironmental transformation -> Pesticide transformation products (metabolite, successor)
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- FDA UNII
- 21 U43KQY7J · 21U43KQY7J
- NIST Chemistry Reference
- 2 · Benzoic acid, 2,5-dichloro-3-hydroxy-6-methoxy-(7600-50-2)
- EPA Substance Registry System
- 5 · 5-Hydroxydicamba (7600-50-2)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 412 · H412-H318-H332-H312-H315-H335-H319-H302
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-P261-P271-P304+P340-P312-P264-P280-P305+P351+P338-P337+P313P-P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P273-P501-P264-P270-P301+P312-P330-P501
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
This chemical does not meet GHS hazard criteria for 7.1% (3 of 42) of reports.
Danger
H302 (92.9%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P273, P280, P301+P317, P305+P354+P338, P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 42 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationCommission Regulation (EC) No 1490/2002
Hazard Classes and CategoriesAcute Tox. 4 (92.9%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H412-H318-H332-H312-H315-H335-H319-H302
- Precautionary statements
- P280-P305+P351+P338-P310-P261-P271-P304+P340-P312-P264-P280-P305+P351+P338-P337+P313P-P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P273-P501-P264-P270-P301+P312-P330-P501
Chemistry & industry
Uses & manufacturing
Use ClassificationEnvironmental transformation -> Pesticide transformation products (metabolite, successor)
Suppliers
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Related reactions
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Compound notes
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