AA48770
136350-52-2 | 1-(4-Bromophenylsulfonyl)pyrrolidine
Manufacturer: A2B Chem
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CatalogNumber
AA48770
ChemicalName
1-(4-Bromophenylsulfonyl)pyrrolidine
CasNumber
136350-52-2
MolecularFormula
C10H12BrNO2S
MolecularWeight
290.1768
MdlNumber
MFCD00584577
Smiles
Brc1ccc(cc1)S(=O)(=O)N1CCCC1
Complexity
298
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
2.2
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CatalogNumber: AA48770
ChemicalName: 1-(4-Bromophenylsulfonyl)pyrrolidine
CasNumber: 136350-52-2
MolecularFormula: C10H12BrNO2S
MolecularWeight: 290.1768
MdlNumber: MFCD00584577
Smiles: Brc1ccc(cc1)S(=O)(=O)N1CCCC1
Complexity: 298
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.2
CatalogNumber:
AA48770
ChemicalName:
1-(4-Bromophenylsulfonyl)pyrrolidine
CasNumber:
136350-52-2
MolecularFormula:
C10H12BrNO2S
MolecularWeight:
290.1768
MdlNumber:
MFCD00584577
Smiles:
Brc1ccc(cc1)S(=O)(=O)N1CCCC1
Complexity:
298
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.2
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MolecularFormula: __
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Smiles: CC(=O)OC[C@H]([C@@H]1OC(=O)[C@@H]([C@@H]1OC(=O)C)OC(=O)C)OC(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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Smiles:
CC(=O)OC[C@H]([C@@H]1OC(=O)[C@@H]([C@@H]1OC(=O)C)OC(=O)C)OC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
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Smiles: Clc1ccccc1Nc1nccs1
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Smiles:
Clc1ccccc1Nc1nccs1
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Smiles: CCC(CC#N)O
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RotatableBondCount: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCC(CC#N)O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
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