AA27093
1237747-77-1 | 3-(4-Trifluoromethoxyphenyl)phenol
Manufacturer: A2B Chem
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CatalogNumber
AA27093
ChemicalName
3-(4-Trifluoromethoxyphenyl)phenol
CasNumber
1237747-77-1
MolecularFormula
C13H9F3O2
MolecularWeight
254.2046
MdlNumber
MFCD18312996
Smiles
Oc1cccc(c1)c1ccc(cc1)OC(F)(F)F
Complexity
260
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
4.4
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CatalogNumber: AA27093
ChemicalName: 3-(4-Trifluoromethoxyphenyl)phenol
CasNumber: 1237747-77-1
MolecularFormula: C13H9F3O2
MolecularWeight: 254.2046
MdlNumber: MFCD18312996
Smiles: Oc1cccc(c1)c1ccc(cc1)OC(F)(F)F
Complexity: 260
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 4.4
CatalogNumber:
AA27093
ChemicalName:
3-(4-Trifluoromethoxyphenyl)phenol
CasNumber:
1237747-77-1
MolecularFormula:
C13H9F3O2
MolecularWeight:
254.2046
MdlNumber:
MFCD18312996
Smiles:
Oc1cccc(c1)c1ccc(cc1)OC(F)(F)F
Complexity:
260
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
4.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: COc1ccc2c(c1)c(=O)n(c(n2)/C=C/c1cccc(c1)[N+](=O)[O-])c1ccc(cc1)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COc1ccc2c(c1)c(=O)n(c(n2)/C=C/c1cccc(c1)[N+](=O)[O-])c1ccc(cc1)C(=O)O
Complexity:
__
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Smiles: N[C@@H]1CCC[C@@H](C1)OC(=O)C
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Smiles:
N[C@@H]1CCC[C@@H](C1)OC(=O)C
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Smiles: CCCCCCCCCCCCOC(=O)C(S(=O)(=O)O)CC(=O)[O-].[NH4+].[NH4+]
Complexity: __
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HeavyAtomCount: __
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HydrogenBondDonorCount: __
RotatableBondCount: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCCCCCCCCCCCOC(=O)C(S(=O)(=O)O)CC(=O)[O-].[NH4+].[NH4+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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