AB46487
82702-31-6 | Methyl 3-bromo-4-fluorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AB46487
ChemicalName
Methyl 3-bromo-4-fluorobenzoate
CasNumber
82702-31-6
MolecularFormula
C8H6BrFO2
MolecularWeight
233.0344
MdlNumber
MFCD04972915
Smiles
COC(=O)c1ccc(c(c1)Br)F
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
2.6
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CatalogNumber: AB46487
ChemicalName: Methyl 3-bromo-4-fluorobenzoate
CasNumber: 82702-31-6
MolecularFormula: C8H6BrFO2
MolecularWeight: 233.0344
MdlNumber: MFCD04972915
Smiles: COC(=O)c1ccc(c(c1)Br)F
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 2.6
CatalogNumber:
AB46487
ChemicalName:
Methyl 3-bromo-4-fluorobenzoate
CasNumber:
82702-31-6
MolecularFormula:
C8H6BrFO2
MolecularWeight:
233.0344
MdlNumber:
MFCD04972915
Smiles:
COC(=O)c1ccc(c(c1)Br)F
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
2.6
CatalogNumber: AB46488
ChemicalName: Methyl 3-bromopicolinate
CasNumber: 53636-56-9
MolecularFormula: C7H6BrNO2
MolecularWeight: 216.032
MdlNumber: MFCD12025946
Smiles: COC(=O)c1ncccc1Br
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.7
CatalogNumber:
AB46488
ChemicalName:
Methyl 3-bromopicolinate
CasNumber:
53636-56-9
MolecularFormula:
C7H6BrNO2
MolecularWeight:
216.032
MdlNumber:
MFCD12025946
Smiles:
COC(=O)c1ncccc1Br
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.7
CatalogNumber: AB46489
ChemicalName: Methyl 3-bromopropionate
CasNumber: 3395-91-3
MolecularFormula: C4H7BrO2
MolecularWeight: 167.0012
MdlNumber: MFCD00000250
Smiles: COC(=O)CCBr
Complexity: 62.7
Covalently-bondedUnitCount: 1
HeavyAtomCount: 7
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 0.8
CatalogNumber:
AB46489
ChemicalName:
Methyl 3-bromopropionate
CasNumber:
3395-91-3
MolecularFormula:
C4H7BrO2
MolecularWeight:
167.0012
MdlNumber:
MFCD00000250
Smiles:
COC(=O)CCBr
Complexity:
62.7
Covalently-bondedUnitCount:
1
HeavyAtomCount:
7
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
0.8
CatalogNumber: AB46490
ChemicalName: Methyl 3-bromopyrazine-2-carboxylate
CasNumber: 51171-02-9
MolecularFormula: C6H5BrN2O2
MolecularWeight: 217.0201
MdlNumber: MFCD08753935
Smiles: COC(=O)c1nccnc1Br
Complexity: 154
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 0.8
CatalogNumber:
AB46490
ChemicalName:
Methyl 3-bromopyrazine-2-carboxylate
CasNumber:
51171-02-9
MolecularFormula:
C6H5BrN2O2
MolecularWeight:
217.0201
MdlNumber:
MFCD08753935
Smiles:
COC(=O)c1nccnc1Br
Complexity:
154
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
0.8