AB52097
1524902-93-9 | Methyl 3-bromo-2,5-difluorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AB52097
ChemicalName
Methyl 3-bromo-2,5-difluorobenzoate
CasNumber
1524902-93-9
MolecularFormula
C8H5BrF2O2
MolecularWeight
251.0249
MdlNumber
MFCD24107103
Smiles
COC(=O)c1cc(F)cc(c1F)Br
Complexity
201
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
2.7
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CatalogNumber: AB52097
ChemicalName: Methyl 3-bromo-2,5-difluorobenzoate
CasNumber: 1524902-93-9
MolecularFormula: C8H5BrF2O2
MolecularWeight: 251.0249
MdlNumber: MFCD24107103
Smiles: COC(=O)c1cc(F)cc(c1F)Br
Complexity: 201
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AB52097
ChemicalName:
Methyl 3-bromo-2,5-difluorobenzoate
CasNumber:
1524902-93-9
MolecularFormula:
C8H5BrF2O2
MolecularWeight:
251.0249
MdlNumber:
MFCD24107103
Smiles:
COC(=O)c1cc(F)cc(c1F)Br
Complexity:
201
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)Cc1ccc2c(n1)cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)Cc1ccc2c(n1)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB52099
ChemicalName: 5-bromo-2-iodophenol
CasNumber: 858855-11-5
MolecularFormula: C6H4BrIO
MolecularWeight: 298.9038
MdlNumber: MFCD16999931
Smiles: Brc1ccc(c(c1)O)I
Complexity: 99.1
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 1
RotatableBondCount: __
Xlogp3: 2.9
CatalogNumber:
AB52099
ChemicalName:
5-bromo-2-iodophenol
CasNumber:
858855-11-5
MolecularFormula:
C6H4BrIO
MolecularWeight:
298.9038
MdlNumber:
MFCD16999931
Smiles:
Brc1ccc(c(c1)O)I
Complexity:
99.1
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
1
RotatableBondCount:
__
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1cccc(c1)N=Nc1ccc(cc1C)N=Nc1c(O)ccc2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1cccc(c1)N=Nc1ccc(cc1C)N=Nc1c(O)ccc2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__