AA36367
1261948-48-4 | 3-(3-Methoxyphenyl)-5-trifluoromethylbenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA36367
ChemicalName
3-(3-Methoxyphenyl)-5-trifluoromethylbenzoic acid
CasNumber
1261948-48-4
MolecularFormula
C15H11F3O3
MolecularWeight
296.2412
MdlNumber
MFCD18319514
Smiles
COc1cccc(c1)c1cc(cc(c1)C(F)(F)F)C(=O)O
Complexity
370
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
3.9
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CatalogNumber: AA36367
ChemicalName: 3-(3-Methoxyphenyl)-5-trifluoromethylbenzoic acid
CasNumber: 1261948-48-4
MolecularFormula: C15H11F3O3
MolecularWeight: 296.2412
MdlNumber: MFCD18319514
Smiles: COc1cccc(c1)c1cc(cc(c1)C(F)(F)F)C(=O)O
Complexity: 370
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.9
CatalogNumber:
AA36367
ChemicalName:
3-(3-Methoxyphenyl)-5-trifluoromethylbenzoic acid
CasNumber:
1261948-48-4
MolecularFormula:
C15H11F3O3
MolecularWeight:
296.2412
MdlNumber:
MFCD18319514
Smiles:
COc1cccc(c1)c1cc(cc(c1)C(F)(F)F)C(=O)O
Complexity:
370
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1ccc(c(c1)c1ccc(nc1)C(=O)O)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Fc1ccc(c(c1)c1ccc(nc1)C(=O)O)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__
CatalogNumber: AA36369
ChemicalName: 4-(3-N,N-Dimethylsulfamoylphenyl)phenol
CasNumber: 1261947-72-1
MolecularFormula: C14H15NO3S
MolecularWeight: 277.3388
MdlNumber: MFCD18313039
Smiles: Oc1ccc(cc1)c1cccc(c1)S(=O)(=O)N(C)C
Complexity: 380
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.3
CatalogNumber:
AA36369
ChemicalName:
4-(3-N,N-Dimethylsulfamoylphenyl)phenol
CasNumber:
1261947-72-1
MolecularFormula:
C14H15NO3S
MolecularWeight:
277.3388
MdlNumber:
MFCD18313039
Smiles:
Oc1ccc(cc1)c1cccc(c1)S(=O)(=O)N(C)C
Complexity:
380
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Oc1ccc(cc1)c1cccc(c1)C(=O)N1CCCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Oc1ccc(cc1)c1cccc(c1)C(=O)N1CCCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__