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3-(2,4-Dichloro-5-fluorophenyl)-1-(4-fluorophenyl)-1H-pyrazole-4-methanol

HCID 3802045
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
618383-38-3
Standard SMILES
OCc1cn(-c2ccc(F)cc2)nc1-c1cc(F)c(Cl)cc1Cl
InChIKey
JGXVQWQSGKJROK-UHFFFAOYSA-N
Molecular formula
C16H10Cl2F2N2O
Average molar mass
355.2 g/mol
Monoisotopic mass
354.0138247

Names & identifiers

Preferred name
3-(2,4-Dichloro-5-fluorophenyl)-1-(4-fluorophenyl)-1H-pyrazole-4-methanol
IUPAC
[3-(2,4-dichloro-5-fluorophenyl)-1-(4-fluorophenyl)pyrazol-4-yl]methanol
English name
(3-(2,4-DICHLORO-5-FLUOROPHENYL)-1-(4-FLUOROPHENYL)-1H-PYRAZOL-4-YL)METHANOL
Molecular formula
C16H10Cl2F2N2O
Molecular weight
355.17

Names & synonyms

618383-38-3(3-(2,4-DICHLORO-5-FLUOROPHENYL)-1-(4-FLUOROPHENYL)-1H-PYRAZOL-4-YL)METHANOLDTXSID4011464313-(2,4-Dichloro-5-fluorophenyl)-1-(4-fluorophenyl)-1H-pyrazole-4-methanol[3-(2,4-dichloro-5-fluorophenyl)-1-(4-fluorophenyl)-1H-pyrazol-4-yl]methanolRefChem:490016DTXCID701578009649-473-0[3-(2,4-dichloro-5-fluorophenyl)-1-(4-fluorophenyl)pyrazol-4-yl]methanol[3-(2,4-dichloro-5-fluoro-phenyl)-1-(4-fluorophenyl)pyrazol-4-yl]methanolAKOS024412299ST51232862
Show more names
SALOR-INT L324485-1EA1H-Pyrazole-4-methanol, 3-(2,4-dichloro-5-fluorophenyl)-1-(4-fluorophenyl)-

Database identifiers

CAS
618383-38-3

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
38.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
23
Formal charge
0
Complexity
398

Physicochemical properties

Hazard statements
413 · H413

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 · 3 items

H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]

P273, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAquatic Chronic 4 (100%)

Safety data

Hazard statements
H413

Chemistry & industry

Suppliers1 total

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
PubChem CID
3802045
DTXSID
DTXSID401146431
EC Number
649-473-0