AH58746
79326-89-9 | 2-Bromo-1-methylimidazole-5-carbaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AH58746
ChemicalName
2-Bromo-1-methylimidazole-5-carbaldehyde
CasNumber
79326-89-9
MolecularFormula
C5H5BrN2O
MolecularWeight
189.01
MdlNumber
MFCD10696276
Smiles
Cn1c(C=O)cnc1Br
Complexity
120
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
0.8
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CatalogNumber: AH58746
ChemicalName: 2-Bromo-1-methylimidazole-5-carbaldehyde
CasNumber: 79326-89-9
MolecularFormula: C5H5BrN2O
MolecularWeight: 189.01
MdlNumber: MFCD10696276
Smiles: Cn1c(C=O)cnc1Br
Complexity: 120
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 0.8
CatalogNumber:
AH58746
ChemicalName:
2-Bromo-1-methylimidazole-5-carbaldehyde
CasNumber:
79326-89-9
MolecularFormula:
C5H5BrN2O
MolecularWeight:
189.01
MdlNumber:
MFCD10696276
Smiles:
Cn1c(C=O)cnc1Br
Complexity:
120
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(C1CC1)Nc1cccc(c1)C(=S)N
Complexity: 276
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(C1CC1)Nc1cccc(c1)C(=S)N
Complexity:
276
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1
CatalogNumber: AH58748
ChemicalName: N-[4-(2-Chloroacetyl)phenyl]benzamide
CasNumber: 853574-47-7
MolecularFormula: C15H12ClNO2
MolecularWeight: 273.7143
MdlNumber: MFCD06655697
Smiles: ClCC(=O)c1ccc(cc1)NC(=O)c1ccccc1
Complexity: 318
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
Xlogp3: 2.9
CatalogNumber:
AH58748
ChemicalName:
N-[4-(2-Chloroacetyl)phenyl]benzamide
CasNumber:
853574-47-7
MolecularFormula:
C15H12ClNO2
MolecularWeight:
273.7143
MdlNumber:
MFCD06655697
Smiles:
ClCC(=O)c1ccc(cc1)NC(=O)c1ccccc1
Complexity:
318
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
Xlogp3:
2.9
CatalogNumber: AH58749
ChemicalName: 5-Chloro-3-(2,5-dichlorophenyl)benzoic acid
CasNumber: 748801-92-5
MolecularFormula: C13H7Cl3O2
MolecularWeight: 301.5525
MdlNumber: MFCD18321875
Smiles: Clc1cc(cc(c1)c1cc(Cl)ccc1Cl)C(=O)O
Complexity: 311
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 5.3
CatalogNumber:
AH58749
ChemicalName:
5-Chloro-3-(2,5-dichlorophenyl)benzoic acid
CasNumber:
748801-92-5
MolecularFormula:
C13H7Cl3O2
MolecularWeight:
301.5525
MdlNumber:
MFCD18321875
Smiles:
Clc1cc(cc(c1)c1cc(Cl)ccc1Cl)C(=O)O
Complexity:
311
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
5.3