AB51768
73898-22-3 | 1-(4-Bromo-3-hydroxyphenyl)ethanone
Manufacturer: A2B Chem
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CatalogNumber
AB51768
ChemicalName
1-(4-Bromo-3-hydroxyphenyl)ethanone
CasNumber
73898-22-3
MolecularFormula
C8H7BrO2
MolecularWeight
215.044
MdlNumber
MFCD17169042
Smiles
CC(=O)c1ccc(c(c1)O)Br
Complexity
158
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.2
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CatalogNumber: AB51768
ChemicalName: 1-(4-Bromo-3-hydroxyphenyl)ethanone
CasNumber: 73898-22-3
MolecularFormula: C8H7BrO2
MolecularWeight: 215.044
MdlNumber: MFCD17169042
Smiles: CC(=O)c1ccc(c(c1)O)Br
Complexity: 158
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.2
CatalogNumber:
AB51768
ChemicalName:
1-(4-Bromo-3-hydroxyphenyl)ethanone
CasNumber:
73898-22-3
MolecularFormula:
C8H7BrO2
MolecularWeight:
215.044
MdlNumber:
MFCD17169042
Smiles:
CC(=O)c1ccc(c(c1)O)Br
Complexity:
158
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: c1ccc(cc1)Cc1nc2c([nH]1)cccc2
Complexity: 223
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
c1ccc(cc1)Cc1nc2c([nH]1)cccc2
Complexity:
223
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C(F)(F)F.CC(C[C@H](B1O[C@H]2[C@](O1)(C)[C@H]1C[C@@H](C2)C1(C)C)N)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C(F)(F)F.CC(C[C@H](B1O[C@H]2[C@](O1)(C)[C@H]1C[C@@H](C2)C1(C)C)N)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB51771
ChemicalName: N-(2,4-di-tert-butyl-5-hydroxyphenyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
CasNumber: 873054-44-5
MolecularFormula: C24H28N2O3
MolecularWeight: 392.4907
MdlNumber: MFCD17171361
Smiles: O=C(c1c[nH]c2c(c1=O)cccc2)Nc1cc(O)c(cc1C(C)(C)C)C(C)(C)C
Complexity: 671
Covalently-bondedUnitCount: 1
HeavyAtomCount: 29
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 4
Xlogp3: 5.6
CatalogNumber:
AB51771
ChemicalName:
N-(2,4-di-tert-butyl-5-hydroxyphenyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
CasNumber:
873054-44-5
MolecularFormula:
C24H28N2O3
MolecularWeight:
392.4907
MdlNumber:
MFCD17171361
Smiles:
O=C(c1c[nH]c2c(c1=O)cccc2)Nc1cc(O)c(cc1C(C)(C)C)C(C)(C)C
Complexity:
671
Covalently-bondedUnitCount:
1
HeavyAtomCount:
29
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
4
Xlogp3:
5.6