AV18713
341006-48-2 | Methyl 3,5-dimethyl-4-(((trifluoromethyl)sulfonyl)oxy)benzoate
Manufacturer: A2B Chem
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CatalogNumber
AV18713
ChemicalName
Methyl 3,5-dimethyl-4-(((trifluoromethyl)sulfonyl)oxy)benzoate
CasNumber
341006-48-2
MolecularFormula
C11H11F3O5S
MolecularWeight
312.2622
MdlNumber
MFCD22420756
Smiles
COC(=O)c1cc(C)c(c(c1)C)OS(=O)(=O)C(F)(F)F
Complexity
442
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
8
RotatableBondCount
4
Xlogp3
3.3
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CatalogNumber: AV18713
ChemicalName: Methyl 3,5-dimethyl-4-(((trifluoromethyl)sulfonyl)oxy)benzoate
CasNumber: 341006-48-2
MolecularFormula: C11H11F3O5S
MolecularWeight: 312.2622
MdlNumber: MFCD22420756
Smiles: COC(=O)c1cc(C)c(c(c1)C)OS(=O)(=O)C(F)(F)F
Complexity: 442
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 8
RotatableBondCount: 4
Xlogp3: 3.3
CatalogNumber:
AV18713
ChemicalName:
Methyl 3,5-dimethyl-4-(((trifluoromethyl)sulfonyl)oxy)benzoate
CasNumber:
341006-48-2
MolecularFormula:
C11H11F3O5S
MolecularWeight:
312.2622
MdlNumber:
MFCD22420756
Smiles:
COC(=O)c1cc(C)c(c(c1)C)OS(=O)(=O)C(F)(F)F
Complexity:
442
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
8
RotatableBondCount:
4
Xlogp3:
3.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CCCCC1)Cc1ccc(cc1)F
Complexity: 230
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1CCCCC1)Cc1ccc(cc1)F
Complexity:
230
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C(=O)c1cn[nH]c1
Complexity: 193
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 0.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)C(=O)c1cn[nH]c1
Complexity:
193
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
0.3
CatalogNumber: AV18717
ChemicalName: 5,6-Dichloro-2-(methylthio)-1H-benzo[d]imidazole
CasNumber: 20076-54-4
MolecularFormula: C8H6Cl2N2S
MolecularWeight: 233.1176
MdlNumber: MFCD00662340
Smiles: CSc1[nH]c2c(n1)cc(c(c2)Cl)Cl
Complexity: 193
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 3.8
CatalogNumber:
AV18717
ChemicalName:
5,6-Dichloro-2-(methylthio)-1H-benzo[d]imidazole
CasNumber:
20076-54-4
MolecularFormula:
C8H6Cl2N2S
MolecularWeight:
233.1176
MdlNumber:
MFCD00662340
Smiles:
CSc1[nH]c2c(n1)cc(c(c2)Cl)Cl
Complexity:
193
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
3.8