AB22428
23233-33-2 | Ethyl 3-bromo-4-fluorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AB22428
ChemicalName
Ethyl 3-bromo-4-fluorobenzoate
CasNumber
23233-33-2
MolecularFormula
C9H8BrFO2
MolecularWeight
247.061
MdlNumber
MFCD06204378
Smiles
CCOC(=O)c1ccc(c(c1)Br)F
Complexity
187
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
2.9
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CatalogNumber: AB22428
ChemicalName: Ethyl 3-bromo-4-fluorobenzoate
CasNumber: 23233-33-2
MolecularFormula: C9H8BrFO2
MolecularWeight: 247.061
MdlNumber: MFCD06204378
Smiles: CCOC(=O)c1ccc(c(c1)Br)F
Complexity: 187
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.9
CatalogNumber:
AB22428
ChemicalName:
Ethyl 3-bromo-4-fluorobenzoate
CasNumber:
23233-33-2
MolecularFormula:
C9H8BrFO2
MolecularWeight:
247.061
MdlNumber:
MFCD06204378
Smiles:
CCOC(=O)c1ccc(c(c1)Br)F
Complexity:
187
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCC[B-](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCC[B-](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(C(=C)C)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COC(C(=C)C)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB22433
ChemicalName: 3,6-Dioxaoctanedioic acid
CasNumber: 23243-68-7
MolecularFormula: C6H10O6
MolecularWeight: 178.14
MdlNumber: MFCD00054502
Smiles: OC(=O)COCCOCC(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB22433
ChemicalName:
3,6-Dioxaoctanedioic acid
CasNumber:
23243-68-7
MolecularFormula:
C6H10O6
MolecularWeight:
178.14
MdlNumber:
MFCD00054502
Smiles:
OC(=O)COCCOCC(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__