AB67241
956-04-7 | 4-Chlorochalcone
Manufacturer: A2B Chem
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CatalogNumber
AB67241
ChemicalName
4-Chlorochalcone
CasNumber
956-04-7
MolecularFormula
C15H11ClO
MolecularWeight
242.7002
MdlNumber
MFCD00016345
Smiles
Clc1ccc(cc1)/C=C/C(=O)c1ccccc1
Complexity
271
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
1
RotatableBondCount
3
Xlogp3
3.7
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CatalogNumber: AB67241
ChemicalName: 4-Chlorochalcone
CasNumber: 956-04-7
MolecularFormula: C15H11ClO
MolecularWeight: 242.7002
MdlNumber: MFCD00016345
Smiles: Clc1ccc(cc1)/C=C/C(=O)c1ccccc1
Complexity: 271
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 1
RotatableBondCount: 3
Xlogp3: 3.7
CatalogNumber:
AB67241
ChemicalName:
4-Chlorochalcone
CasNumber:
956-04-7
MolecularFormula:
C15H11ClO
MolecularWeight:
242.7002
MdlNumber:
MFCD00016345
Smiles:
Clc1ccc(cc1)/C=C/C(=O)c1ccccc1
Complexity:
271
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
1
RotatableBondCount:
3
Xlogp3:
3.7
CatalogNumber: AB67242
ChemicalName: 4-Chlorocinnamaldehyde
CasNumber: 49678-02-6
MolecularFormula: C9H7ClO
MolecularWeight: 166.6043
MdlNumber: MFCD00156880
Smiles: O=C/C=C/c1ccc(cc1)Cl
Complexity: 146
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AB67242
ChemicalName:
4-Chlorocinnamaldehyde
CasNumber:
49678-02-6
MolecularFormula:
C9H7ClO
MolecularWeight:
166.6043
MdlNumber:
MFCD00156880
Smiles:
O=C/C=C/c1ccc(cc1)Cl
Complexity:
146
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C=Cc1ccc(cc1)Cl
Complexity: 181
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C=Cc1ccc(cc1)Cl
Complexity:
181
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#CC=Cc1ccc(cc1)Cl
Complexity: 181
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#CC=Cc1ccc(cc1)Cl
Complexity:
181
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.3