AG67293
60166-86-1 | 5-(Methylsulfonyl)thiophene-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AG67293
ChemicalName
5-(Methylsulfonyl)thiophene-2-carboxylic acid
CasNumber
60166-86-1
MolecularFormula
C6H6O4S2
MolecularWeight
206.2394
MdlNumber
MFCD00173745
Smiles
OC(=O)c1ccc(s1)S(=O)(=O)C
Complexity
276
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1
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CatalogNumber: AG67293
ChemicalName: 5-(Methylsulfonyl)thiophene-2-carboxylic acid
CasNumber: 60166-86-1
MolecularFormula: C6H6O4S2
MolecularWeight: 206.2394
MdlNumber: MFCD00173745
Smiles: OC(=O)c1ccc(s1)S(=O)(=O)C
Complexity: 276
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1
CatalogNumber:
AG67293
ChemicalName:
5-(Methylsulfonyl)thiophene-2-carboxylic acid
CasNumber:
60166-86-1
MolecularFormula:
C6H6O4S2
MolecularWeight:
206.2394
MdlNumber:
MFCD00173745
Smiles:
OC(=O)c1ccc(s1)S(=O)(=O)C
Complexity:
276
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1
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Smiles: [O-][N+](=O)c1c(N)cccc1[N+](=O)[O-]
Complexity: __
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Smiles:
[O-][N+](=O)c1c(N)cccc1[N+](=O)[O-]
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Smiles: ClCC(=O)c1cc(n(c1C)c1ccc(cc1)Cl)C
Complexity: __
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Smiles:
ClCC(=O)c1cc(n(c1C)c1ccc(cc1)Cl)C
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: NCc1cc2c(s1)cccc2
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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:
NCc1cc2c(s1)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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