Basic information
- CAS
63284-71-9- Standard SMILES
OC(c1ccc(F)cc1)(c1cncnc1)c1ccccc1Cl- InChIKey
SAPGTCDSBGMXCD-UHFFFAOYSA-N- Molecular formula
- C17H12ClFN2O
- Average molar mass
- 314.7 g/mol
- Monoisotopic mass
- 314.0622189
Overview
inhibits C14-demethylation in oat & rye sterol biosynthesis; RN given refers to cpd without isomeric designation
Names & identifiers
- Preferred name
- Nuarimol
- IUPAC
- (2-chlorophenyl)-(4-fluorophenyl)-pyrimidin-5-ylmethanol
- English name
- NUARIMOL
- Molecular formula
- C17H12ClFN2O
- Molecular weight
- 314.74
Names & synonyms
Nuarimol63284-71-9TriminolGuantletMuroxCaswell No. 419GDTXSID2042220EL 228EL 2289ZU7K80U0CYalpha-(2-Chlorophenyl)-alpha-(4-fluorophenyl)-5-pyrimidinemethanolEL-2289
Show more names
el228C11185el2289Trimioltrimifruitsc
5-Pyrimidinemethanol, alpha-(2-chlorophenyl)-alpha-(4-fluorophenyl)-(2-chlorophenyl)-(4-fluorophenyl)-pyrimidin-5-yl-methanolDTXCID0022220RefChem:166938CHEBI:7645alpha-(2-chlorophenyl)-alpha-(4-fluorophenyl)-5-pyrimidine methanolTrimidalTrimifruit SC
Database identifiers
- CAS
63284-71-9- PubChem CID
- 91683
- DTXSID
DTXSID2042220- ChEMBL
CHEMBL1863087- UNII
- ZU7K80U0CY
- EC Number
- 264-071-1
- Nikkaji
- J19.555C
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 46 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 359
Experimental & physicochemical properties
Pesticides
Fungicides
Active substance -> EU Pesticides database: Not approved
Pesticide (Nuarimol) -> USDA PDB
LogP2.2
Collision Cross Section171.6 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID2042220]
Physicochemical properties
- Melting point
- 126 °C · 126°C
- Boiling point
- 475.2 · 475.2±40.0 °C(Predicted)
- Density
- 1.3255 · 1.3255 (estimate)
- vapor pressure
- 1 x · 1 x 10-5 Pa at 23 °C
- storage temp.
- 0 · 0-6°C
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- pka
- 11.37 · 11.37±0.29(Predicted)
- Water Solubility
- 26 mg · 26 mg l-1 (pH 7) at 25 °C
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]
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 70 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information2004/129/EC
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- UV9279700
- risk_code
- 22-36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 26
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H319
- Hazard Classifications
- Acute Tox. 4 OralEye Irrit. 2
- Precautionary statements
- P264-P270-P280-P301+P312-P305+P351+P338-P337+P313
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationChemicals that kill or inhibit the growth of fungi in agricultural applications, on wood, plastics, or other materials, in swimming pools, etc.
Uses & manufacturing
General Manufacturing Information5-Pyrimidinemethanol, .alpha.-(2-chlorophenyl)-.alpha.-(4-fluorophenyl)-: ACTIVE
Applications
UsesNuarimol is a systemic fungicide with both curative and protective activity. It controls a wide range of pathogenic fungi, e.g. Cercosporella spp., Septoria spp., Ustilago spp., powdery mildews, leaf spot, etc. in cereals (as a foliar spray and as a seed treatment), powdery mildews on pome fruits, stone fruits, vines, cucurbits and other crops and scab on apples.
UsesNuarimol is used in the preparation of difluoroethyl-containing heterocyclic compounds useful as antiviral agents and fungicides. Also used as a substance in the modelling inhibition of avian aromatase by azole pesticides.
Suppliers39 total
湖北万得化工有限公司15377098680 15377098680 · [email protected]
上海莉凯化工技术有限公司16628776521 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
医恩医疗系统研发（上海）有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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