AF33910
3114-31-6 | 1-(4-Bromo-3-chlorophenyl)ethanone
Manufacturer: A2B Chem
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CatalogNumber
AF33910
ChemicalName
1-(4-Bromo-3-chlorophenyl)ethanone
CasNumber
3114-31-6
MolecularFormula
C8H6BrClO
MolecularWeight
233.4896
MdlNumber
MFCD14636445
Smiles
CC(=O)c1ccc(c(c1)Cl)Br
Complexity
160
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
1
RotatableBondCount
1
Xlogp3
2.9
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CatalogNumber: AF33910
ChemicalName: 1-(4-Bromo-3-chlorophenyl)ethanone
CasNumber: 3114-31-6
MolecularFormula: C8H6BrClO
MolecularWeight: 233.4896
MdlNumber: MFCD14636445
Smiles: CC(=O)c1ccc(c(c1)Cl)Br
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 2.9
CatalogNumber:
AF33910
ChemicalName:
1-(4-Bromo-3-chlorophenyl)ethanone
CasNumber:
3114-31-6
MolecularFormula:
C8H6BrClO
MolecularWeight:
233.4896
MdlNumber:
MFCD14636445
Smiles:
CC(=O)c1ccc(c(c1)Cl)Br
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
2.9
CatalogNumber: AF33911
ChemicalName: 1,2-Dibromo-3-nitrobenzene
CasNumber: 26429-41-4
MolecularFormula: C6H3Br2NO2
MolecularWeight: 280.9015
MdlNumber: MFCD00049051
Smiles: O=N(=O)c1cccc(c1Br)Br
Complexity: 159
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: __
Xlogp3: 3.2
CatalogNumber:
AF33911
ChemicalName:
1,2-Dibromo-3-nitrobenzene
CasNumber:
26429-41-4
MolecularFormula:
C6H3Br2NO2
MolecularWeight:
280.9015
MdlNumber:
MFCD00049051
Smiles:
O=N(=O)c1cccc(c1Br)Br
Complexity:
159
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
__
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: c1cnc2c(c1)ccnc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
c1cnc2c(c1)ccnc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF33913
ChemicalName: 1-Methyl-4-oxocyclohexanecarboxylic acid
CasNumber: 24463-41-0
MolecularFormula: C8H12O3
MolecularWeight: 156.1791
MdlNumber: MFCD18374767
Smiles: O=C1CCC(CC1)(C)C(=O)O
Complexity: 186
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 0.3
CatalogNumber:
AF33913
ChemicalName:
1-Methyl-4-oxocyclohexanecarboxylic acid
CasNumber:
24463-41-0
MolecularFormula:
C8H12O3
MolecularWeight:
156.1791
MdlNumber:
MFCD18374767
Smiles:
O=C1CCC(CC1)(C)C(=O)O
Complexity:
186
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
0.3