AA89634
16734-98-8 | 4-(4-Methylsulfonylphenyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA89634
ChemicalName
4-(4-Methylsulfonylphenyl)benzoic acid
CasNumber
16734-98-8
MolecularFormula
C14H12O4S
MolecularWeight
276.3077
MdlNumber
MFCD06802567
Smiles
OC(=O)c1ccc(cc1)c1ccc(cc1)S(=O)(=O)C
Complexity
407
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.3
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CatalogNumber: AA89634
ChemicalName: 4-(4-Methylsulfonylphenyl)benzoic acid
CasNumber: 16734-98-8
MolecularFormula: C14H12O4S
MolecularWeight: 276.3077
MdlNumber: MFCD06802567
Smiles: OC(=O)c1ccc(cc1)c1ccc(cc1)S(=O)(=O)C
Complexity: 407
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.3
CatalogNumber:
AA89634
ChemicalName:
4-(4-Methylsulfonylphenyl)benzoic acid
CasNumber:
16734-98-8
MolecularFormula:
C14H12O4S
MolecularWeight:
276.3077
MdlNumber:
MFCD06802567
Smiles:
OC(=O)c1ccc(cc1)c1ccc(cc1)S(=O)(=O)C
Complexity:
407
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1ccc(cc1)c1cccc(c1)S(=O)(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
OC(=O)c1ccc(cc1)c1cccc(c1)S(=O)(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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Smiles: [Li]C1C=CC=C1
Complexity: __
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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MolecularFormula:
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Smiles:
[Li]C1C=CC=C1
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: NNC(=O)c1nccs1
Complexity: __
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HydrogenBondDonorCount: __
RotatableBondCount: __
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:
NNC(=O)c1nccs1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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