AB63109
1072944-70-7 | 3-(2-Bromophenyl)-5-ethyl-1,2,4-oxadiazole
Manufacturer: A2B Chem
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CatalogNumber
AB63109
ChemicalName
3-(2-Bromophenyl)-5-ethyl-1,2,4-oxadiazole
CasNumber
1072944-70-7
MolecularFormula
C10H9BrN2O
MolecularWeight
253.0953
MdlNumber
MFCD11504917
Smiles
CCc1onc(n1)c1ccccc1Br
Complexity
191
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
3.3
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CatalogNumber: AB63109
ChemicalName: 3-(2-Bromophenyl)-5-ethyl-1,2,4-oxadiazole
CasNumber: 1072944-70-7
MolecularFormula: C10H9BrN2O
MolecularWeight: 253.0953
MdlNumber: MFCD11504917
Smiles: CCc1onc(n1)c1ccccc1Br
Complexity: 191
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 3.3
CatalogNumber:
AB63109
ChemicalName:
3-(2-Bromophenyl)-5-ethyl-1,2,4-oxadiazole
CasNumber:
1072944-70-7
MolecularFormula:
C10H9BrN2O
MolecularWeight:
253.0953
MdlNumber:
MFCD11504917
Smiles:
CCc1onc(n1)c1ccccc1Br
Complexity:
191
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
3.3
CatalogNumber: AB63110
ChemicalName: 3-(2-Bromo-phenyl)-propan-1-ol
CasNumber: 52221-92-8
MolecularFormula: C9H11BrO
MolecularWeight: 215.087
MdlNumber: MFCD09028685
Smiles: OCCCc1ccccc1Br
Complexity: 106
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
RotatableBondCount: 3
Xlogp3: 2.5
CatalogNumber:
AB63110
ChemicalName:
3-(2-Bromo-phenyl)-propan-1-ol
CasNumber:
52221-92-8
MolecularFormula:
C9H11BrO
MolecularWeight:
215.087
MdlNumber:
MFCD09028685
Smiles:
OCCCc1ccccc1Br
Complexity:
106
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
RotatableBondCount:
3
Xlogp3:
2.5
CatalogNumber: AB63111
ChemicalName: 2-(2-Carboxyethyl)benzoic acid
CasNumber: 776-79-4
MolecularFormula: C10H10O4
MolecularWeight: 194.184
MdlNumber: MFCD00016550
Smiles: OC(=O)CCc1ccccc1C(=O)O
Complexity: 224
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 1.9
CatalogNumber:
AB63111
ChemicalName:
2-(2-Carboxyethyl)benzoic acid
CasNumber:
776-79-4
MolecularFormula:
C10H10O4
MolecularWeight:
194.184
MdlNumber:
MFCD00016550
Smiles:
OC(=O)CCc1ccccc1C(=O)O
Complexity:
224
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
1.9
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Smiles: COc1cccc(c1Cl)CCC(=O)O
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Smiles:
COc1cccc(c1Cl)CCC(=O)O
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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