Basic information
- CAS
956394-36-8- Standard SMILES
Cc1nn(COc2ccc(F)cc2F)c(C)c1N- InChIKey
HACMXUZTKLJVRS-UHFFFAOYSA-N- Molecular formula
- C12H13F2N3O
- Average molar mass
- 253.25 g/mol
- Monoisotopic mass
- 253.10266837
Names & identifiers
- Preferred name
- 1-[(2,4-Difluorophenoxy)methyl]-3,5-dimethyl-1H-pyrazol-4-amine
- IUPAC
- 1-[(2,4-difluorophenoxy)methyl]-3,5-dimethylpyrazol-4-amine
- English name
- 1-(2,4-Difluoro-phenoxymethyl)-3,5-dimethyl-1H-pyrazol-4-ylamine
- Molecular formula
- C12H13F2N3O
- Molecular weight
- 253.25
Names & synonyms
956394-36-81-[(2,4-difluorophenoxy)methyl]-3,5-dimethyl-1H-pyrazol-4-amine1-((2,4-difluorophenoxy)methyl)-3,5-dimethyl-1h-pyrazol-4-amineRefChem:2220121-[(2,4-difluorophenoxy)methyl]-3,5-dimethylpyrazol-4-amine1-[(2,4-difluorophenoxy)methyl]-3,5-dimethyl-pyrazol-4-amine1-[(2,4-difluorophenoxy)methyl]-3,5-dimethylpyrazole-4-ylamineDTXSID101176380GNB394361-(2,4-Difluoro-phenoxymethyl)-3,5-dimethyl-1H-pyrazol-4-ylamineMFCD04967699SBB021462
Show more names
AKOS B016637AKOS PAO-1642ART-CHEM-BB B016637
STK349339AKOS000306206ST065590VS-09718CS-0240577EN300-2291261-(2,4-difluorophenoxymethyl)-3,5-dimethyl-1h-pyrazol-4-amine1-(2,4-Difluoro-phenoxymethyl)-3,5-dimethyl-1 H -pyrazol-4-ylamine
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 53.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 282
Chemistry & industry
Suppliers2 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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