AE62351
1423037-19-7 | 4-Bromo-2-ethoxy-5-fluorobenzonitrile
Manufacturer: A2B Chem
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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
RotatableBondCount
2
Xlogp3
2.8
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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
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
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
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
RotatableBondCount:
3
Xlogp3:
2.2
CatalogNumber: AE62353
ChemicalName: (3E)-4-(3-Bromo-4-ethoxyphenyl)but-3-en-2-one
CasNumber: 1393444-15-9
MolecularFormula: C12H13BrO2
MolecularWeight: 269.1344
MdlNumber: MFCD22383783
Smiles: CCOc1ccc(cc1Br)/C=C/C(=O)C
Complexity: 238
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
Xlogp3: 3.1
CatalogNumber:
AE62353
ChemicalName:
(3E)-4-(3-Bromo-4-ethoxyphenyl)but-3-en-2-one
CasNumber:
1393444-15-9
MolecularFormula:
C12H13BrO2
MolecularWeight:
269.1344
MdlNumber:
MFCD22383783
Smiles:
CCOc1ccc(cc1Br)/C=C/C(=O)C
Complexity:
238
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
Xlogp3:
3.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#Cc1cc(Br)c2c(c1)ncn2CC
Complexity: 259
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1cc(Br)c2c(c1)ncn2CC
Complexity:
259
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.1