Credazine
Basic information
- CAS
14491-59-9- Standard SMILES
Cc1ccccc1Oc1cccnn1- InChIKey
DNPSYFHJYIRREW-UHFFFAOYSA-N- Molecular formula
- C11H10N2O
- Average molar mass
- 186.21 g/mol
- Monoisotopic mass
- 186.07931295
Overview
Credazine is an aromatic ether.
Names & identifiers
- Preferred name
- Credazine
- IUPAC
- 3-(2-methylphenoxy)pyridazine
- English name
- 5-23-11-00075 (Beilstein Handbook Reference)
- Molecular formula
- C11H10N2O
- Molecular weight
- 186.21
Names & synonyms
CREDAZINE3-(2-Methylphenoxy)pyridazineKusakiraPyridazine, 3-(2-methylphenoxy)-NIA 20439SW-6701SW-6721UNII-FD71DT6I5ZH-722FD71DT6I5ZBRN 0880257DTXSID3074525
Show more names
SW-670Credazin
5-23-11-00075 (Beilstein Handbook Reference)PYRIDAZIN-3-YL O-TOLYL ETHERRefChem:128431DTXCID603471214491-59-93-(o-Tolyloxy)pyridazineSCHEMBL134448orb1697660
Database identifiers
- CAS
14491-59-9- PubChem CID
- 26715
- DTXSID
DTXSID3074525- ChEBI
CHEBI:82237- UNII
- FD71DT6I5Z
- Nikkaji
- J8.506E
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 35 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 175
Physicochemical properties
- Melting point
- 78 °C · 78°C
- Boiling point
- 320.7 °C · 320.7°C (rough estimate)
- Density
- 1.1458 · 1.1458 (rough estimate)
- refractive index
- 1.53 · 1.5300 (estimate)
- Water Solubility
- 1.996 g/L · 1.996g/L(temperature not stated)
- FDA UNII
- 71 DT6I5Z · FD71DT6I5Z
- EPA Substance Registry System
- 3 · Pyridazine, 3-(2-methylphenoxy)- (14491-59-9)
Chemistry & industry
Applications
DescriptionCredazine is an obsolete herbicide that was used to control grasses and broadleaved weeds. The substance has not been extensively studied and so little information is known regarding its environmental fate, ecotoxicity or impact on human health.
Additional notes
DefinitionChEBI: Credazine is an aromatic ether.
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Related reactions
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Compound notes
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