(1-(4-CL-PH)-3-(2,3-Dihydro-1,4-benzodioxin-6-YL)-1H-pyrazol-4-YL)methanol
Basic information
- CAS
618383-37-2- Standard SMILES
OCc1cn(-c2ccc(Cl)cc2)nc1-c1ccc2c(c1)OCCO2- InChIKey
DPMPGOFVVPOQNV-UHFFFAOYSA-N- Molecular formula
- C18H15ClN2O3
- Average molar mass
- 342.8 g/mol
- Monoisotopic mass
- 342.07712
Names & identifiers
- Preferred name
- (1-(4-CL-PH)-3-(2,3-Dihydro-1,4-benzodioxin-6-YL)-1H-pyrazol-4-YL)methanol
- IUPAC
- [1-(4-chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrazol-4-yl]methanol
- English name
- (1-(4-Chlorophenyl)-3-(2,3-dihydrobenzo[b][1,4]dioxin-7-yl)-1H-pyrazol-4-yl)methanol
- Molecular formula
- C18H15ClN2O3
- Molecular weight
- 342.78
Names & synonyms
618383-37-2RefChem:391752(1-(4-CL-PH)-3-(2,3-Dihydro-1,4-benzodioxin-6-YL)-1H-pyrazol-4-YL)methanol649-478-8(1-(4-CHLOROPHENYL)-3-(2,3-DIHYDROBENZO[B][1,4]DIOXIN-7-YL)-1H-PYRAZOL-4-YL)METHANOL(1-(4-Chlorophenyl)-3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-1H-pyrazol-4-yl)methanol[1-(4-chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrazol-4-yl]methanolZINC02541931AKOS024412298ST51232861[1-(4-chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-4-yl]methanolSALOR-INT L324477-1EA
Show more names
1H-Pyrazole-4-methanol, 1-(4-chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-JR-2344, (1-(4-Chlorophenyl)-3-(2,3-dihydrobenzo[b][1,4]dioxin-7-yl)-1H-pyrazol-4-yl)methanol, 97%
Database identifiers
- CAS
618383-37-2- PubChem CID
- 3484982
- EC Number
- 649-478-8
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 56.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 419
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H315-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H315-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Suppliers
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Related reactions
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Compound notes
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