Drazoxolon
Basic information
- CAS
1005512-62-8- Standard SMILES
Cc1[nH]oc(=O)c1N=Nc1ccccc1Cl- InChIKey
OOTHTARUZHONSW-UHFFFAOYSA-N- Molecular formula
- C10H8ClN3O2
- Average molar mass
- 237.64 g/mol
- Monoisotopic mass
- 237.0305042
Overview
Drazoxolon is a member of phenylhydrazines.
Names & identifiers
- Preferred name
- Drazoxolon
- IUPAC
- 4-[(2-chlorophenyl)diazenyl]-3-methyl-2H-1,2-oxazol-5-one
- English name
- DRAZOXOLON
- Molecular formula
- C10H8ClN3O2
- Molecular weight
- 237.64
Names & synonyms
DRAZOXOLON5707-69-7DrazoxoloneSaisanMil-colGanocideSopracolMilcolSopracol 781Caswell No. 207CDrazoxolon [BSI:ISO]PP781
Show more names
JF 800PP 781JF 1633JF 2067R 22395
3-Methyl-4-(o-chlorophenylhydrazono)-5-isoxazoloneEINECS 227-197-84-(2-Chlorophenylhydrazono)-3-methyl-5(4H)-isoxazoloneEPA Pesticide Chemical Code 207400HYDRAZOLON4-(2-Chlorophenylhydrazone)-3-methyl-5-isoxazolone8B76Z92B5MDRAZOXOLON [MI]
Database identifiers
- CAS
1005512-62-8、5707-69-7- PubChem CID
- 21929
- DTXSID
DTXSID10859925- ChEBI
CHEBI:82071- UNII
- 8B76Z92B5M
- EC Number
- 227-197-8
- Nikkaji
- J31.843D
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 63.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 354
Experimental & physicochemical properties
SpringerMaterials PropertiesFusion temperature
Pesticides
Fungicides
Active substance -> EU Pesticides database: Not approved
LogP2.6
Ionization Efficiency
Positive
2.04
2.7
Agilent XCT
Electrospray ionization
formic acid (5.3nM)
Physicochemical properties
- Melting point
- 168 ℃ · 168℃
- Boiling point
- 321.8 · 321.8±44.0 °C(Predicted)
- Density
- 1.5583 · 1.5583 (rough estimate)
- refractive index
- 1.579 · 1.5790 (estimate)
- Flash point
- 100 °C · >100 °C
- pka
- 9.13 · 9.13±0.40(Predicted)
- Merck
- 13 · 13,3478
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
Danger
H301: Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P273, P301+P316, P321, P330, P391, P405, and P501 (click each P-code to see the statement)
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P273, P301+P316, P321, P330, P391, P405, and P501 (click each P-code to see the statement)
Hazard information
Regulatory Information2002/2076
DOT Hazard Classification
Drazoxolon
Marine pollutant
Hazard Classes and Categories
Acute Tox. 3 (100%)
Acute toxicity - category 3
Acute Tox. 3 *
Safety data
- rtecs
- NY2800000
- ridadr
- 2588
- hs_code
- 29349990
- Toxicity
- LD50 orally in female rats, mice: 126, 129 mg/kg (Clark, McElligott)
- risk_code
- 25-50/53
- Signal word
- Danger
- Symbol(GHS)
- GHS06,GHS09
- hazard_code
- T,N
- safety_code
- 22-24-36/37-45-60-61
- hazard_class
- 6.1(b)
- packing_group
- III
Chemistry & industry
Applications
DescriptionInhibits nucleic acid synthesis (DNA and RNA synthesis) in fungal cells, preventing their growth and reproduction
UsesFungicide.
Additional notes
DefinitionChEBI: Drazoxolon is a member of phenylhydrazines.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…