AB65400
1877-64-1 | 3-(Methylsulfonyl)phenylacetic acid
Manufacturer: A2B Chem
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CatalogNumber
AB65400
ChemicalName
3-(Methylsulfonyl)phenylacetic acid
CasNumber
1877-64-1
MolecularFormula
C9H10O4S
MolecularWeight
214.2383
MdlNumber
MFCD03426066
Smiles
OC(=O)Cc1cccc(c1)S(=O)(=O)C
Complexity
301
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.1
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CatalogNumber: AB65400
ChemicalName: 3-(Methylsulfonyl)phenylacetic acid
CasNumber: 1877-64-1
MolecularFormula: C9H10O4S
MolecularWeight: 214.2383
MdlNumber: MFCD03426066
Smiles: OC(=O)Cc1cccc(c1)S(=O)(=O)C
Complexity: 301
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.1
CatalogNumber:
AB65400
ChemicalName:
3-(Methylsulfonyl)phenylacetic acid
CasNumber:
1877-64-1
MolecularFormula:
C9H10O4S
MolecularWeight:
214.2383
MdlNumber:
MFCD03426066
Smiles:
OC(=O)Cc1cccc(c1)S(=O)(=O)C
Complexity:
301
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1OC(=O)C2C1C(C)C=CC2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1OC(=O)C2C1C(C)C=CC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CSC(C(=O)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CSC(C(=O)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#Cc1sccc1C
Complexity: 124
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1sccc1C
Complexity:
124
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2