AA53255
1215310-75-0 | 2-Formyl-5-(methylsulphonyl)benzotrifluoride
Manufacturer: A2B Chem
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CatalogNumber
AA53255
ChemicalName
2-Formyl-5-(methylsulphonyl)benzotrifluoride
CasNumber
1215310-75-0
MolecularFormula
C9H7F3O3S
MolecularWeight
252.2103
MdlNumber
MFCD15479075
Smiles
O=Cc1ccc(cc1C(F)(F)F)S(=O)(=O)C
Complexity
355
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
6
RotatableBondCount
2
Xlogp3
1.5
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CatalogNumber: AA53255
ChemicalName: 2-Formyl-5-(methylsulphonyl)benzotrifluoride
CasNumber: 1215310-75-0
MolecularFormula: C9H7F3O3S
MolecularWeight: 252.2103
MdlNumber: MFCD15479075
Smiles: O=Cc1ccc(cc1C(F)(F)F)S(=O)(=O)C
Complexity: 355
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 6
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AA53255
ChemicalName:
2-Formyl-5-(methylsulphonyl)benzotrifluoride
CasNumber:
1215310-75-0
MolecularFormula:
C9H7F3O3S
MolecularWeight:
252.2103
MdlNumber:
MFCD15479075
Smiles:
O=Cc1ccc(cc1C(F)(F)F)S(=O)(=O)C
Complexity:
355
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
6
RotatableBondCount:
2
Xlogp3:
1.5
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Smiles: CNCc1cnc(nc1)N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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Smiles:
CNCc1cnc(nc1)N
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RotatableBondCount:
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Smiles: CCCCCC[C@H](CCO)O
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CCCCCC[C@H](CCO)O
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RotatableBondCount:
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Xlogp3:
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Smiles: S=C(Nc1ccc(cc1)F)NCC(c1ccccc1)O
Complexity: __
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HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
S=C(Nc1ccc(cc1)F)NCC(c1ccccc1)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__