AE95521
185388-85-6 | 6-(Trifluoromethoxy)-2,3-dihydro-1h-inden-1-one
Manufacturer: A2B Chem
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CatalogNumber
AE95521
ChemicalName
6-(Trifluoromethoxy)-2,3-dihydro-1h-inden-1-one
CasNumber
185388-85-6
MolecularFormula
C10H7F3O2
MolecularWeight
216.1566
MdlNumber
MFCD11518646
Smiles
O=C1CCc2c1cc(cc2)OC(F)(F)F
Complexity
262
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
RotatableBondCount
1
Xlogp3
2.8
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CatalogNumber: AE95521
ChemicalName: 6-(Trifluoromethoxy)-2,3-dihydro-1h-inden-1-one
CasNumber: 185388-85-6
MolecularFormula: C10H7F3O2
MolecularWeight: 216.1566
MdlNumber: MFCD11518646
Smiles: O=C1CCc2c1cc(cc2)OC(F)(F)F
Complexity: 262
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 2.8
CatalogNumber:
AE95521
ChemicalName:
6-(Trifluoromethoxy)-2,3-dihydro-1h-inden-1-one
CasNumber:
185388-85-6
MolecularFormula:
C10H7F3O2
MolecularWeight:
216.1566
MdlNumber:
MFCD11518646
Smiles:
O=C1CCc2c1cc(cc2)OC(F)(F)F
Complexity:
262
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: CCCCCCCC(=O)O[Fe]OC(=O)CCCCCCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
CCCCCCCC(=O)O[Fe]OC(=O)CCCCCCC
Complexity:
__
Covalently-bondedUnitCount:
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__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: SC[C@H]1O[C@@H]2O[C@@H]3[C@@H](CS)O[C@@H]([C@@H]([C@H]3O)O)O[C@@H]3[C@@H](CS)O[C@@H]([C@@H]([C@H]3O)O)O[C@@H]3[C@H](O[C@H](O[C@@H]4[C@H](O[C@H](O[C@@H]5[C@H](O[C@H](O[C@H]1[C@@H]([C@H]2O)O)[C@H](O)[C@H]5O)CS)[C@H](O)[C@H]4O)CS)[C@@H]([C@H]3O)O)CS
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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MolecularWeight:
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Smiles:
SC[C@H]1O[C@@H]2O[C@@H]3[C@@H](CS)O[C@@H]([C@@H]([C@H]3O)O)O[C@@H]3[C@@H](CS)O[C@@H]([C@@H]([C@H]3O)O)O[C@@H]3[C@H](O[C@H](O[C@@H]4[C@H](O[C@H](O[C@@H]5[C@H](O[C@H](O[C@H]1[C@@H]([C@H]2O)O)[C@H](O)[C@H]5O)CS)[C@H](O)[C@H]4O)CS)[C@@H]([C@H]3O)O)CS
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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ChemicalName: __
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MolecularFormula: __
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Smiles: CCCC1=NN1
Complexity: __
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HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
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ChemicalName:
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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:
CCCC1=NN1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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