AB13110
191724-12-6 | 4-(3-Trifluoromethylphenyl)phenol
Manufacturer: A2B Chem
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CatalogNumber
AB13110
ChemicalName
4-(3-Trifluoromethylphenyl)phenol
CasNumber
191724-12-6
MolecularFormula
C13H9F3O
MolecularWeight
238.2052
MdlNumber
MFCD06801898
Smiles
Oc1ccc(cc1)c1cccc(c1)C(F)(F)F
Complexity
244
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
4.1
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CatalogNumber: AB13110
ChemicalName: 4-(3-Trifluoromethylphenyl)phenol
CasNumber: 191724-12-6
MolecularFormula: C13H9F3O
MolecularWeight: 238.2052
MdlNumber: MFCD06801898
Smiles: Oc1ccc(cc1)c1cccc(c1)C(F)(F)F
Complexity: 244
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 4.1
CatalogNumber:
AB13110
ChemicalName:
4-(3-Trifluoromethylphenyl)phenol
CasNumber:
191724-12-6
MolecularFormula:
C13H9F3O
MolecularWeight:
238.2052
MdlNumber:
MFCD06801898
Smiles:
Oc1ccc(cc1)c1cccc(c1)C(F)(F)F
Complexity:
244
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
4.1
CatalogNumber: AB13111
ChemicalName: 4-(3-Hydroxymethylphenyl)phenol
CasNumber: 191724-10-4
MolecularFormula: C13H12O2
MolecularWeight: 200.2332
MdlNumber: MFCD17677632
Smiles: OCc1cccc(c1)c1ccc(cc1)O
Complexity: 185
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 2.3
CatalogNumber:
AB13111
ChemicalName:
4-(3-Hydroxymethylphenyl)phenol
CasNumber:
191724-10-4
MolecularFormula:
C13H12O2
MolecularWeight:
200.2332
MdlNumber:
MFCD17677632
Smiles:
OCc1cccc(c1)c1ccc(cc1)O
Complexity:
185
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: OC(=O)C(F)(F)F.CC([C@@H](C(=O)Nc1ccc2c(c1)oc(=O)cc2C)N)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
OC(=O)C(F)(F)F.CC([C@@H](C(=O)Nc1ccc2c(c1)oc(=O)cc2C)N)C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: C[C@H]([C@@H](C(=O)Nc1ccc2c(c1)oc(=O)cc2C)N)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C[C@H]([C@@H](C(=O)Nc1ccc2c(c1)oc(=O)cc2C)N)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__