AI65246
96145-98-1 | 2-Phenyl-5-trifluoromethyl-2H-pyrazol-3-ol
Manufacturer: A2B Chem
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CatalogNumber
AI65246
ChemicalName
2-Phenyl-5-trifluoromethyl-2H-pyrazol-3-ol
CasNumber
96145-98-1
MolecularFormula
C10H7F3N2O
MolecularWeight
228.1706
MdlNumber
MFCD03714773
Smiles
Oc1cc(nn1c1ccccc1)C(F)(F)F
Complexity
319
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.4
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CatalogNumber: AI65246
ChemicalName: 2-Phenyl-5-trifluoromethyl-2H-pyrazol-3-ol
CasNumber: 96145-98-1
MolecularFormula: C10H7F3N2O
MolecularWeight: 228.1706
MdlNumber: MFCD03714773
Smiles: Oc1cc(nn1c1ccccc1)C(F)(F)F
Complexity: 319
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.4
CatalogNumber:
AI65246
ChemicalName:
2-Phenyl-5-trifluoromethyl-2H-pyrazol-3-ol
CasNumber:
96145-98-1
MolecularFormula:
C10H7F3N2O
MolecularWeight:
228.1706
MdlNumber:
MFCD03714773
Smiles:
Oc1cc(nn1c1ccccc1)C(F)(F)F
Complexity:
319
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)C(=O)Oc1ccc(cc1)CCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)C(=O)Oc1ccc(cc1)CCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)[C@H]1CCCN1C(=O)CCl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)[C@H]1CCCN1C(=O)CCl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C/C=C/[C@@H]1CC[C@H](CC1)c1ccc(cc1)C#N
Complexity: 293
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 4.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C/C=C/[C@@H]1CC[C@H](CC1)c1ccc(cc1)C#N
Complexity:
293
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
4.8