AB42728
170141-63-6 | 3'-(Trifluoromethoxy)acetophenone
Manufacturer: A2B Chem
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CatalogNumber
AB42728
ChemicalName
3'-(Trifluoromethoxy)acetophenone
CasNumber
170141-63-6
MolecularFormula
C9H7F3O2
MolecularWeight
204.1459
MdlNumber
MFCD00042403
Smiles
CC(=O)c1cccc(c1)OC(F)(F)F
Complexity
213
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
RotatableBondCount
2
Xlogp3
3.1
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CatalogNumber: AB42728
ChemicalName: 3'-(Trifluoromethoxy)acetophenone
CasNumber: 170141-63-6
MolecularFormula: C9H7F3O2
MolecularWeight: 204.1459
MdlNumber: MFCD00042403
Smiles: CC(=O)c1cccc(c1)OC(F)(F)F
Complexity: 213
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
Xlogp3: 3.1
CatalogNumber:
AB42728
ChemicalName:
3'-(Trifluoromethoxy)acetophenone
CasNumber:
170141-63-6
MolecularFormula:
C9H7F3O2
MolecularWeight:
204.1459
MdlNumber:
MFCD00042403
Smiles:
CC(=O)c1cccc(c1)OC(F)(F)F
Complexity:
213
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
Xlogp3:
3.1
CatalogNumber: AB42729
ChemicalName: 1-(2-Hydroxyethyl)-3,3-dimethylindolino-6'-nitrobenzopyrylospiran
CasNumber: 16111-07-2
MolecularFormula: C20H20N2O4
MolecularWeight: 352.3838
MdlNumber: MFCD00369031
Smiles: OCCN1c2ccccc2C(C21C=Cc1c(O2)ccc(c1)[N+](=O)[O-])(C)C
Complexity: 587
Covalently-bondedUnitCount: 1
HeavyAtomCount: 26
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
Xlogp3: 4.1
CatalogNumber:
AB42729
ChemicalName:
1-(2-Hydroxyethyl)-3,3-dimethylindolino-6'-nitrobenzopyrylospiran
CasNumber:
16111-07-2
MolecularFormula:
C20H20N2O4
MolecularWeight:
352.3838
MdlNumber:
MFCD00369031
Smiles:
OCCN1c2ccccc2C(C21C=Cc1c(O2)ccc(c1)[N+](=O)[O-])(C)C
Complexity:
587
Covalently-bondedUnitCount:
1
HeavyAtomCount:
26
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
Xlogp3:
4.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1NC(=O)CC2(C1)CCCC2
Complexity: 211
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1NC(=O)CC2(C1)CCCC2
Complexity:
211
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1
CatalogNumber: AB42731
ChemicalName: 3-Bromo-5-fluoropyridine
CasNumber: 407-20-5
MolecularFormula: C5H3BrFN
MolecularWeight: 175.9864
MdlNumber: MFCD04112555
Smiles: Fc1cncc(c1)Br
Complexity: 78.8
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
RotatableBondCount: __
Xlogp3: 1.6
CatalogNumber:
AB42731
ChemicalName:
3-Bromo-5-fluoropyridine
CasNumber:
407-20-5
MolecularFormula:
C5H3BrFN
MolecularWeight:
175.9864
MdlNumber:
MFCD04112555
Smiles:
Fc1cncc(c1)Br
Complexity:
78.8
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
RotatableBondCount:
__
Xlogp3:
1.6