AB30473
263400-88-0 | 3-(Methylsulfonyl)propyl 4-methylbenzenesulfonate
Manufacturer: A2B Chem
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CatalogNumber
AB30473
ChemicalName
3-(Methylsulfonyl)propyl 4-methylbenzenesulfonate
CasNumber
263400-88-0
MolecularFormula
C11H16O5S2
MolecularWeight
292.3717
MdlNumber
MFCD22124592
Smiles
Cc1ccc(cc1)S(=O)(=O)OCCCS(=O)(=O)C
Complexity
433
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
RotatableBondCount
6
Xlogp3
1.2
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CatalogNumber: AB30473
ChemicalName: 3-(Methylsulfonyl)propyl 4-methylbenzenesulfonate
CasNumber: 263400-88-0
MolecularFormula: C11H16O5S2
MolecularWeight: 292.3717
MdlNumber: MFCD22124592
Smiles: Cc1ccc(cc1)S(=O)(=O)OCCCS(=O)(=O)C
Complexity: 433
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
RotatableBondCount: 6
Xlogp3: 1.2
CatalogNumber:
AB30473
ChemicalName:
3-(Methylsulfonyl)propyl 4-methylbenzenesulfonate
CasNumber:
263400-88-0
MolecularFormula:
C11H16O5S2
MolecularWeight:
292.3717
MdlNumber:
MFCD22124592
Smiles:
Cc1ccc(cc1)S(=O)(=O)OCCCS(=O)(=O)C
Complexity:
433
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
RotatableBondCount:
6
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
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Smiles: COc1cc2c(Cl)ncnc2cc1O
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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Smiles:
COc1cc2c(Cl)ncnc2cc1O
Complexity:
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__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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Smiles: O=c1[nH]ccc2c1CCCC2
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Smiles:
O=c1[nH]ccc2c1CCCC2
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HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Smiles: O[C@@H]1[C@H]2CC[C@@H]3[C@]1(C[C@@H](O)[C@]1([C@H]([C@]3(C)O)[C@H]3[C@@H](C1(C)C)O3)O)C[C@@]2(C)O
Complexity: __
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HeavyAtomCount: __
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MolecularWeight:
__
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Smiles:
O[C@@H]1[C@H]2CC[C@@H]3[C@]1(C[C@@H](O)[C@]1([C@H]([C@]3(C)O)[C@H]3[C@@H](C1(C)C)O3)O)C[C@@]2(C)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__