AB75837
22821-70-1 | Methyl 4-methanesulfonylbenzoate
Manufacturer: A2B Chem
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CatalogNumber
AB75837
ChemicalName
Methyl 4-methanesulfonylbenzoate
CasNumber
22821-70-1
MolecularFormula
C9H10O4S
MolecularWeight
214.2383
MdlNumber
MFCD00100037
Smiles
COC(=O)c1ccc(cc1)S(=O)(=O)C
Complexity
293
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
1.3
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CatalogNumber: AB75837
ChemicalName: Methyl 4-methanesulfonylbenzoate
CasNumber: 22821-70-1
MolecularFormula: C9H10O4S
MolecularWeight: 214.2383
MdlNumber: MFCD00100037
Smiles: COC(=O)c1ccc(cc1)S(=O)(=O)C
Complexity: 293
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 1.3
CatalogNumber:
AB75837
ChemicalName:
Methyl 4-methanesulfonylbenzoate
CasNumber:
22821-70-1
MolecularFormula:
C9H10O4S
MolecularWeight:
214.2383
MdlNumber:
MFCD00100037
Smiles:
COC(=O)c1ccc(cc1)S(=O)(=O)C
Complexity:
293
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc(cc1)SC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc(cc1)SC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CSCCCC(=O)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CSCCCC(=O)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB75840
ChemicalName: Methyl 4-(trifluoromethylthio)benzoate
CasNumber: 88489-60-5
MolecularFormula: C9H7F3O2S
MolecularWeight: 236.2109
MdlNumber: MFCD06203725
Smiles: COC(=O)c1ccc(cc1)SC(F)(F)F
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
RotatableBondCount: 3
Xlogp3: 4
CatalogNumber:
AB75840
ChemicalName:
Methyl 4-(trifluoromethylthio)benzoate
CasNumber:
88489-60-5
MolecularFormula:
C9H7F3O2S
MolecularWeight:
236.2109
MdlNumber:
MFCD06203725
Smiles:
COC(=O)c1ccc(cc1)SC(F)(F)F
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
RotatableBondCount:
3
Xlogp3:
4