AE62222
1393441-85-4 | Methyl 3-[3-(benzyloxy)phenyl]-4-fluorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AE62222
ChemicalName
Methyl 3-[3-(benzyloxy)phenyl]-4-fluorobenzoate
CasNumber
1393441-85-4
MolecularFormula
C21H17FO3
MolecularWeight
336.3563
MdlNumber
MFCD22383722
Smiles
COC(=O)c1ccc(c(c1)c1cccc(c1)OCc1ccccc1)F
Complexity
421
Covalently-bondedUnitCount
1
HeavyAtomCount
25
HydrogenBondAcceptorCount
4
RotatableBondCount
6
Xlogp3
5
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CatalogNumber: AE62222
ChemicalName: Methyl 3-[3-(benzyloxy)phenyl]-4-fluorobenzoate
CasNumber: 1393441-85-4
MolecularFormula: C21H17FO3
MolecularWeight: 336.3563
MdlNumber: MFCD22383722
Smiles: COC(=O)c1ccc(c(c1)c1cccc(c1)OCc1ccccc1)F
Complexity: 421
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 4
RotatableBondCount: 6
Xlogp3: 5
CatalogNumber:
AE62222
ChemicalName:
Methyl 3-[3-(benzyloxy)phenyl]-4-fluorobenzoate
CasNumber:
1393441-85-4
MolecularFormula:
C21H17FO3
MolecularWeight:
336.3563
MdlNumber:
MFCD22383722
Smiles:
COC(=O)c1ccc(c(c1)c1cccc(c1)OCc1ccccc1)F
Complexity:
421
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
4
RotatableBondCount:
6
Xlogp3:
5
CatalogNumber: AE62223
ChemicalName: Methyl 2,4-bis(furan-2-yl)benzoate
CasNumber: 1414029-43-8
MolecularFormula: C16H12O4
MolecularWeight: 268.2641
MdlNumber: MFCD22574956
Smiles: COC(=O)c1ccc(cc1c1ccco1)c1ccco1
Complexity: 343
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 3.2
CatalogNumber:
AE62223
ChemicalName:
Methyl 2,4-bis(furan-2-yl)benzoate
CasNumber:
1414029-43-8
MolecularFormula:
C16H12O4
MolecularWeight:
268.2641
MdlNumber:
MFCD22574956
Smiles:
COC(=O)c1ccc(cc1c1ccco1)c1ccco1
Complexity:
343
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
3.2
CatalogNumber: AE62224
ChemicalName: 6-Bromo-2-methoxypyridine-3-boronic acid
CasNumber: 1242314-44-8
MolecularFormula: C6H7BBrNO3
MolecularWeight: 231.83968000000002
MdlNumber: MFCD18382838
Smiles: COc1nc(Br)ccc1B(O)O
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AE62224
ChemicalName:
6-Bromo-2-methoxypyridine-3-boronic acid
CasNumber:
1242314-44-8
MolecularFormula:
C6H7BBrNO3
MolecularWeight:
231.83968000000002
MdlNumber:
MFCD18382838
Smiles:
COc1nc(Br)ccc1B(O)O
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
__
CatalogNumber: AE62225
ChemicalName: Methyl 7-bromo-1-methyl-1,2,3-benzotriazole-5-carboxylate
CasNumber: 1420800-14-1
MolecularFormula: C9H8BrN3O2
MolecularWeight: 270.0827
MdlNumber: MFCD22689137
Smiles: COC(=O)c1cc(Br)c2c(c1)nnn2C
Complexity: 264
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 1.7
CatalogNumber:
AE62225
ChemicalName:
Methyl 7-bromo-1-methyl-1,2,3-benzotriazole-5-carboxylate
CasNumber:
1420800-14-1
MolecularFormula:
C9H8BrN3O2
MolecularWeight:
270.0827
MdlNumber:
MFCD22689137
Smiles:
COC(=O)c1cc(Br)c2c(c1)nnn2C
Complexity:
264
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
1.7