AD39738
383-10-8 | 1-Methyl-4-(trifluoromethylsulfonyl)benzene
Manufacturer: A2B Chem
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CatalogNumber
AD39738
ChemicalName
1-Methyl-4-(trifluoromethylsulfonyl)benzene
CasNumber
383-10-8
MolecularFormula
C8H7F3O2S
MolecularWeight
224.20018959999996
MdlNumber
MFCD00523749
Smiles
FC(S(=O)(=O)c1ccc(cc1)C)(F)F
Complexity
281
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
RotatableBondCount
1
Xlogp3
3
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CatalogNumber: AD39738
ChemicalName: 1-Methyl-4-(trifluoromethylsulfonyl)benzene
CasNumber: 383-10-8
MolecularFormula: C8H7F3O2S
MolecularWeight: 224.20018959999996
MdlNumber: MFCD00523749
Smiles: FC(S(=O)(=O)c1ccc(cc1)C)(F)F
Complexity: 281
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 3
CatalogNumber:
AD39738
ChemicalName:
1-Methyl-4-(trifluoromethylsulfonyl)benzene
CasNumber:
383-10-8
MolecularFormula:
C8H7F3O2S
MolecularWeight:
224.20018959999996
MdlNumber:
MFCD00523749
Smiles:
FC(S(=O)(=O)c1ccc(cc1)C)(F)F
Complexity:
281
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
3
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Smiles: FC1(Br)CCC1(F)F
Complexity: __
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HydrogenBondAcceptorCount: __
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Smiles:
FC1(Br)CCC1(F)F
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CCCCN(S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCOC(=O)C=C
Complexity: __
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Smiles:
CCCCN(S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCOC(=O)C=C
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: Brc1ccc2c3c1ccc1c3c(cc2)c(cc1Br)Br
Complexity: __
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Xlogp3: __
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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:
Brc1ccc2c3c1ccc1c3c(cc2)c(cc1Br)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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