AI65135
959748-73-3 | 2-(Oxan-4-yl)ethyl 4-methylbenzenesulfonate
Manufacturer: A2B Chem
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CatalogNumber
AI65135
ChemicalName
2-(Oxan-4-yl)ethyl 4-methylbenzenesulfonate
CasNumber
959748-73-3
MolecularFormula
C14H20O4S
MolecularWeight
284.3712
MdlNumber
MFCD23378508
Smiles
Cc1ccc(cc1)S(=O)(=O)OCCC1CCOCC1
Complexity
346
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
RotatableBondCount
5
Xlogp3
2.4
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CatalogNumber: AI65135
ChemicalName: 2-(Oxan-4-yl)ethyl 4-methylbenzenesulfonate
CasNumber: 959748-73-3
MolecularFormula: C14H20O4S
MolecularWeight: 284.3712
MdlNumber: MFCD23378508
Smiles: Cc1ccc(cc1)S(=O)(=O)OCCC1CCOCC1
Complexity: 346
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
Xlogp3: 2.4
CatalogNumber:
AI65135
ChemicalName:
2-(Oxan-4-yl)ethyl 4-methylbenzenesulfonate
CasNumber:
959748-73-3
MolecularFormula:
C14H20O4S
MolecularWeight:
284.3712
MdlNumber:
MFCD23378508
Smiles:
Cc1ccc(cc1)S(=O)(=O)OCCC1CCOCC1
Complexity:
346
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
Xlogp3:
2.4
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Smiles: Clc1ccc(c(c1)C(=O)O)OC(F)(F)F
Complexity: __
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HeavyAtomCount: __
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Xlogp3: __
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Smiles:
Clc1ccc(c(c1)C(=O)O)OC(F)(F)F
Complexity:
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RotatableBondCount:
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Smiles: OC[C@@H]1C[C@@H](C1)O[Si](C(C)(C)C)(C)C
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Smiles:
OC[C@@H]1C[C@@H](C1)O[Si](C(C)(C)C)(C)C
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HeavyAtomCount:
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Smiles: NC(C(=O)O)CC12C[C@@H]3C[C@H](C2)C[C@H](C1)C3
Complexity: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
NC(C(=O)O)CC12C[C@@H]3C[C@H](C2)C[C@H](C1)C3
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__