2-(5-methyl-4-phenyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol
Basic information
- CAS
716330-83-5- Standard SMILES
C=C(C)COc1ccc(-c2n[nH]c(C)c2-c2ccccc2)c(O)c1- InChIKey
VAXWGBXCSPXBFY-UHFFFAOYSA-N- Molecular formula
- C20H20N2O2
- Average molar mass
- 320.4 g/mol
Names & identifiers
- Preferred name
- 2-(5-methyl-4-phenyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol
- IUPAC
- 2-(5-methyl-4-phenyl-1H-pyrazol-3-yl)-5-(2-methylprop-2-enoxy)phenol
- English name
- 2-(5-methyl-4-phenyl-1H-pyrazol-3-yl)-5-[(2-methylprop-2-en-1-yl)oxy]phenol
- Molecular formula
- C20H20N2O2
- Molecular weight
- 320.39
Names & synonyms
MLS0000830812-(5-methyl-4-phenyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol716330-83-5SMR0000458952-(5-methyl-4-phenyl-1H-pyrazol-3-yl)-5-[(2-methylprop-2-en-1-yl)oxy]phenolMLS002584008CHEMBL1430319BDBM56932cid_5389906HMS2173B07STK921726AKOS002224838
Show more names
Phenol, 2-(5-methyl-4-phenyl-1H-pyrazol-3-yl)-5-[(2-methyl-2-propen-1-yl)oxy]-
CCG-275169(6Z)-6-(5-methyl-4-phenyl-1,2-dihydropyrazol-3-ylidene)-3-(2-methylprop-2-enoxy)cyclohexa-2,4-dien-1-oneST50470740F3385-11582-(5-methyl-4-phenyl-1H-pyrazol-3-yl)-5-(2-methylprop-2-enoxy)phenol2-(5-methyl-4-phenylpyrazol-3-yl)-5-(2-methylprop-2-enyloxy)phenol(6Z)-3-(2-methylallyloxy)-6-(5-methyl-4-phenyl-3-pyrazolin-3-ylidene)cyclohexa-2,4-dien-1-one(6Z)-6-(5-methyl-4-phenyl-1,2-dihydropyrazol-3-ylidene)-3-(2-methylprop-2-enoxy)-1-cyclohexa-2,4-dienone
Database identifiers
- CAS
716330-83-5- ChEMBL
CHEMBL1430319
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 58.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 422
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…