AD66249
108485-08-1 | N-Ethyl 2-bromo-4-nitroaniline
Manufacturer: A2B Chem
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CatalogNumber
AD66249
ChemicalName
N-Ethyl 2-bromo-4-nitroaniline
CasNumber
108485-08-1
MolecularFormula
C8H9BrN2O2
MolecularWeight
245.0733
MdlNumber
MFCD12044149
Smiles
CCNc1ccc(cc1Br)[N+](=O)[O-]
Complexity
184
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.8
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CatalogNumber: AD66249
ChemicalName: N-Ethyl 2-bromo-4-nitroaniline
CasNumber: 108485-08-1
MolecularFormula: C8H9BrN2O2
MolecularWeight: 245.0733
MdlNumber: MFCD12044149
Smiles: CCNc1ccc(cc1Br)[N+](=O)[O-]
Complexity: 184
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.8
CatalogNumber:
AD66249
ChemicalName:
N-Ethyl 2-bromo-4-nitroaniline
CasNumber:
108485-08-1
MolecularFormula:
C8H9BrN2O2
MolecularWeight:
245.0733
MdlNumber:
MFCD12044149
Smiles:
CCNc1ccc(cc1Br)[N+](=O)[O-]
Complexity:
184
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.8
CatalogNumber: AD66250
ChemicalName: Methyl 2-fluoro-5-hydroxybenzoate
CasNumber: 1084801-91-1
MolecularFormula: C8H7FO3
MolecularWeight: 170.1378
MdlNumber: MFCD12406843
Smiles: COC(=O)c1cc(O)ccc1F
Complexity: 172
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AD66250
ChemicalName:
Methyl 2-fluoro-5-hydroxybenzoate
CasNumber:
1084801-91-1
MolecularFormula:
C8H7FO3
MolecularWeight:
170.1378
MdlNumber:
MFCD12406843
Smiles:
COC(=O)c1cc(O)ccc1F
Complexity:
172
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)c1ccc(cc1C)C(=O)O
Complexity: 282
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)c1ccc(cc1C)C(=O)O
Complexity:
282
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccccc1OCc1ccccc1C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
Cc1ccccc1OCc1ccccc1C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__