AI33295
1379309-82-6 | 5-Bromo-2-methanesulfonylbenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AI33295
ChemicalName
5-Bromo-2-methanesulfonylbenzonitrile
CasNumber
1379309-82-6
MolecularFormula
C8H6BrNO2S
MolecularWeight
260.1077
MdlNumber
MFCD18378496
Smiles
N#Cc1cc(Br)ccc1S(=O)(=O)C
Complexity
324
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
1.6
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CatalogNumber: AI33295
ChemicalName: 5-Bromo-2-methanesulfonylbenzonitrile
CasNumber: 1379309-82-6
MolecularFormula: C8H6BrNO2S
MolecularWeight: 260.1077
MdlNumber: MFCD18378496
Smiles: N#Cc1cc(Br)ccc1S(=O)(=O)C
Complexity: 324
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 1.6
CatalogNumber:
AI33295
ChemicalName:
5-Bromo-2-methanesulfonylbenzonitrile
CasNumber:
1379309-82-6
MolecularFormula:
C8H6BrNO2S
MolecularWeight:
260.1077
MdlNumber:
MFCD18378496
Smiles:
N#Cc1cc(Br)ccc1S(=O)(=O)C
Complexity:
324
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
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Smiles: Brc1ccc2c(c1)nc(nc2Cl)N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
Brc1ccc2c(c1)nc(nc2Cl)N
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: CC1(C)OCC2(C1)CCNCC2.Cl
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Smiles:
CC1(C)OCC2(C1)CCNCC2.Cl
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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Smiles: COC(=O)C1(CC1)c1ccccc1Br
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
COC(=O)C1(CC1)c1ccccc1Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__