AB93186
88357-16-8 | 4-(tert-Butylsulfanyl)benzenecarbaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AB93186
ChemicalName
4-(tert-Butylsulfanyl)benzenecarbaldehyde
CasNumber
88357-16-8
MolecularFormula
C11H14OS
MolecularWeight
194.2933
MdlNumber
MFCD08443944
Smiles
O=Cc1ccc(cc1)SC(C)(C)C
Complexity
163
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
RotatableBondCount
3
Xlogp3
2.9
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CatalogNumber: AB93186
ChemicalName: 4-(tert-Butylsulfanyl)benzenecarbaldehyde
CasNumber: 88357-16-8
MolecularFormula: C11H14OS
MolecularWeight: 194.2933
MdlNumber: MFCD08443944
Smiles: O=Cc1ccc(cc1)SC(C)(C)C
Complexity: 163
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 2.9
CatalogNumber:
AB93186
ChemicalName:
4-(tert-Butylsulfanyl)benzenecarbaldehyde
CasNumber:
88357-16-8
MolecularFormula:
C11H14OS
MolecularWeight:
194.2933
MdlNumber:
MFCD08443944
Smiles:
O=Cc1ccc(cc1)SC(C)(C)C
Complexity:
163
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
2.9
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Smiles: O=C(c1cocc1)N1CCNCC1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
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Smiles:
O=C(c1cocc1)N1CCNCC1
Complexity:
__
Covalently-bondedUnitCount:
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__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: CC(=O)Nc1ccc(cc1)OC[C@](C(=O)Nc1ccc(c(c1)C(F)(F)F)[N+](=O)[O-])(O)C
Complexity: __
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Smiles:
CC(=O)Nc1ccc(cc1)OC[C@](C(=O)Nc1ccc(c(c1)C(F)(F)F)[N+](=O)[O-])(O)C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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Smiles: CCOC(=O)c1cnn(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCOC(=O)c1cnn(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__