AE62349
1261977-17-6 | 3-Bromo-5-[4-(ethoxycarbonyl)-3-fluorophenyl]phenol
Manufacturer: A2B Chem
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CatalogNumber
AE62349
ChemicalName
3-Bromo-5-[4-(ethoxycarbonyl)-3-fluorophenyl]phenol
CasNumber
1261977-17-6
MolecularFormula
C15H12BrFO3
MolecularWeight
339.1564
MdlNumber
MFCD18316156
Smiles
CCOC(=O)c1ccc(cc1F)c1cc(O)cc(c1)Br
Complexity
339
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
4.2
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CatalogNumber: AE62349
ChemicalName: 3-Bromo-5-[4-(ethoxycarbonyl)-3-fluorophenyl]phenol
CasNumber: 1261977-17-6
MolecularFormula: C15H12BrFO3
MolecularWeight: 339.1564
MdlNumber: MFCD18316156
Smiles: CCOC(=O)c1ccc(cc1F)c1cc(O)cc(c1)Br
Complexity: 339
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 4.2
CatalogNumber:
AE62349
ChemicalName:
3-Bromo-5-[4-(ethoxycarbonyl)-3-fluorophenyl]phenol
CasNumber:
1261977-17-6
MolecularFormula:
C15H12BrFO3
MolecularWeight:
339.1564
MdlNumber:
MFCD18316156
Smiles:
CCOC(=O)c1ccc(cc1F)c1cc(O)cc(c1)Br
Complexity:
339
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
4.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOc1cc(F)c(cc1Br)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOc1cc(F)c(cc1Br)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AE62351
ChemicalName: 4-Bromo-2-ethoxy-5-fluorobenzonitrile
CasNumber: 1423037-19-7
MolecularFormula: C9H7BrFNO
MolecularWeight: 244.0604
MdlNumber: MFCD23135913
Smiles: CCOc1cc(Br)c(cc1C#N)F
Complexity: 215
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 2.8
CatalogNumber:
AE62351
ChemicalName:
4-Bromo-2-ethoxy-5-fluorobenzonitrile
CasNumber:
1423037-19-7
MolecularFormula:
C9H7BrFNO
MolecularWeight:
244.0604
MdlNumber:
MFCD23135913
Smiles:
CCOc1cc(Br)c(cc1C#N)F
Complexity:
215
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
2.8
CatalogNumber: AE62352
ChemicalName: 4-Bromo-2-ethoxy-1-methanesulfonylbenzene
CasNumber: 1423037-38-0
MolecularFormula: C9H11BrO3S
MolecularWeight: 279.1508
MdlNumber: MFCD23135974
Smiles: CCOc1cc(Br)ccc1S(=O)(=O)C
Complexity: 270
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 2.2
CatalogNumber:
AE62352
ChemicalName:
4-Bromo-2-ethoxy-1-methanesulfonylbenzene
CasNumber:
1423037-38-0
MolecularFormula:
C9H11BrO3S
MolecularWeight:
279.1508
MdlNumber:
MFCD23135974
Smiles:
CCOc1cc(Br)ccc1S(=O)(=O)C
Complexity:
270
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
2.2