AB64670
91842-77-2 | 3-Chloro-4-(methylsulfonyl)nitrobenzene
Manufacturer: A2B Chem
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CatalogNumber
AB64670
ChemicalName
3-Chloro-4-(methylsulfonyl)nitrobenzene
CasNumber
91842-77-2
MolecularFormula
C7H6ClNO4S
MolecularWeight
235.64484000000004
MdlNumber
MFCD08692409
Smiles
Clc1cc(ccc1S(=O)(=O)C)[N+](=O)[O-]
Complexity
318
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
1
Xlogp3
1.6
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CatalogNumber: AB64670
ChemicalName: 3-Chloro-4-(methylsulfonyl)nitrobenzene
CasNumber: 91842-77-2
MolecularFormula: C7H6ClNO4S
MolecularWeight: 235.64484000000004
MdlNumber: MFCD08692409
Smiles: Clc1cc(ccc1S(=O)(=O)C)[N+](=O)[O-]
Complexity: 318
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 1.6
CatalogNumber:
AB64670
ChemicalName:
3-Chloro-4-(methylsulfonyl)nitrobenzene
CasNumber:
91842-77-2
MolecularFormula:
C7H6ClNO4S
MolecularWeight:
235.64484000000004
MdlNumber:
MFCD08692409
Smiles:
Clc1cc(ccc1S(=O)(=O)C)[N+](=O)[O-]
Complexity:
318
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
1.6
CatalogNumber: AB64671
ChemicalName: 3-Chloro-4-(trifluoromethoxy)aniline
CasNumber: 64628-73-5
MolecularFormula: C7H5ClF3NO
MolecularWeight: 211.5689
MdlNumber: MFCD00190126
Smiles: Nc1ccc(c(c1)Cl)OC(F)(F)F
Complexity: 176
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 3.2
CatalogNumber:
AB64671
ChemicalName:
3-Chloro-4-(trifluoromethoxy)aniline
CasNumber:
64628-73-5
MolecularFormula:
C7H5ClF3NO
MolecularWeight:
211.5689
MdlNumber:
MFCD00190126
Smiles:
Nc1ccc(c(c1)Cl)OC(F)(F)F
Complexity:
176
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
3.2
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Smiles: N#Cc1ccc(c(c1)Cl)OC(F)(F)F
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HydrogenBondAcceptorCount: __
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Smiles:
N#Cc1ccc(c(c1)Cl)OC(F)(F)F
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: Nc1ccc(c(c1)Cl)SC(F)(F)F
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
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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MdlNumber:
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Smiles:
Nc1ccc(c(c1)Cl)SC(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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