AG79683
647856-10-8 | 4-Bromo-2-(trifluoromethoxy)thioanisole
Manufacturer: A2B Chem
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CatalogNumber
AG79683
ChemicalName
4-Bromo-2-(trifluoromethoxy)thioanisole
CasNumber
647856-10-8
MolecularFormula
C8H6BrF3OS
MolecularWeight
287.0968
MdlNumber
MFCD15527444
Smiles
CSc1ccc(cc1OC(F)(F)F)Br
Complexity
188
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
RotatableBondCount
2
Xlogp3
4.3
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CatalogNumber: AG79683
ChemicalName: 4-Bromo-2-(trifluoromethoxy)thioanisole
CasNumber: 647856-10-8
MolecularFormula: C8H6BrF3OS
MolecularWeight: 287.0968
MdlNumber: MFCD15527444
Smiles: CSc1ccc(cc1OC(F)(F)F)Br
Complexity: 188
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
Xlogp3: 4.3
CatalogNumber:
AG79683
ChemicalName:
4-Bromo-2-(trifluoromethoxy)thioanisole
CasNumber:
647856-10-8
MolecularFormula:
C8H6BrF3OS
MolecularWeight:
287.0968
MdlNumber:
MFCD15527444
Smiles:
CSc1ccc(cc1OC(F)(F)F)Br
Complexity:
188
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
Xlogp3:
4.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCN(S(=O)(=O)c1ccccc1N)CC
Complexity: 280
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCN(S(=O)(=O)c1ccccc1N)CC
Complexity:
280
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.5
CatalogNumber: AG79687
ChemicalName: 4-[Benzo(b)thiophen-2-yl]phenol
CasNumber: 65540-08-1
MolecularFormula: C14H10OS
MolecularWeight: 226.2936
MdlNumber: MFCD18312903
Smiles: Oc1ccc(cc1)c1cc2c(s1)cccc2
Complexity: 235
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 4.2
CatalogNumber:
AG79687
ChemicalName:
4-[Benzo(b)thiophen-2-yl]phenol
CasNumber:
65540-08-1
MolecularFormula:
C14H10OS
MolecularWeight:
226.2936
MdlNumber:
MFCD18312903
Smiles:
Oc1ccc(cc1)c1cc2c(s1)cccc2
Complexity:
235
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
4.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCN1CCN(CC1)c1ccc(c(c1)Cl)C=O
Complexity: 254
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCN1CCN(CC1)c1ccc(c(c1)Cl)C=O
Complexity:
254
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.3