AA88788
16634-88-1 | 5-Bromo-2-hydroxy-3-nitrobenzaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AA88788
ChemicalName
5-Bromo-2-hydroxy-3-nitrobenzaldehyde
CasNumber
16634-88-1
MolecularFormula
C7H4BrNO4
MolecularWeight
246.015
MdlNumber
MFCD00130110
Smiles
O=Cc1cc(Br)cc(c1O)[N+](=O)[O-]
Complexity
217
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AA88788
ChemicalName: 5-Bromo-2-hydroxy-3-nitrobenzaldehyde
CasNumber: 16634-88-1
MolecularFormula: C7H4BrNO4
MolecularWeight: 246.015
MdlNumber: MFCD00130110
Smiles: O=Cc1cc(Br)cc(c1O)[N+](=O)[O-]
Complexity: 217
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AA88788
ChemicalName:
5-Bromo-2-hydroxy-3-nitrobenzaldehyde
CasNumber:
16634-88-1
MolecularFormula:
C7H4BrNO4
MolecularWeight:
246.015
MdlNumber:
MFCD00130110
Smiles:
O=Cc1cc(Br)cc(c1O)[N+](=O)[O-]
Complexity:
217
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: AA88790
ChemicalName: 4-(4-Aminophenyl)-N,N-dimethylbenzamide
CasNumber: 166386-41-0
MolecularFormula: C15H16N2O
MolecularWeight: 240.3003
MdlNumber: MFCD20231502
Smiles: CN(C(=O)c1ccc(cc1)c1ccc(cc1)N)C
Complexity: 274
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.3
CatalogNumber:
AA88790
ChemicalName:
4-(4-Aminophenyl)-N,N-dimethylbenzamide
CasNumber:
166386-41-0
MolecularFormula:
C15H16N2O
MolecularWeight:
240.3003
MdlNumber:
MFCD20231502
Smiles:
CN(C(=O)c1ccc(cc1)c1ccc(cc1)N)C
Complexity:
274
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.3
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Smiles: NC(=O)c1ccc(cc1)c1ccc(cc1)C(=O)O
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NC(=O)c1ccc(cc1)c1ccc(cc1)C(=O)O
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Smiles: CCOC(=O)C(C(C1COC(O1)(C)C)O)(F)F
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Smiles:
CCOC(=O)C(C(C1COC(O1)(C)C)O)(F)F
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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