AA55264
1221179-04-9 | Methyl 4-benzyloxy-2-fluorobenzoate
Manufacturer: A2B Chem
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CatalogNumber
AA55264
ChemicalName
Methyl 4-benzyloxy-2-fluorobenzoate
CasNumber
1221179-04-9
MolecularFormula
C15H13FO3
MolecularWeight
260.2603
MdlNumber
MFCD19684121
Smiles
COC(=O)c1ccc(cc1F)OCc1ccccc1
Complexity
289
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
RotatableBondCount
5
Xlogp3
3.3
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CatalogNumber: AA55264
ChemicalName: Methyl 4-benzyloxy-2-fluorobenzoate
CasNumber: 1221179-04-9
MolecularFormula: C15H13FO3
MolecularWeight: 260.2603
MdlNumber: MFCD19684121
Smiles: COC(=O)c1ccc(cc1F)OCc1ccccc1
Complexity: 289
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
Xlogp3: 3.3
CatalogNumber:
AA55264
ChemicalName:
Methyl 4-benzyloxy-2-fluorobenzoate
CasNumber:
1221179-04-9
MolecularFormula:
C15H13FO3
MolecularWeight:
260.2603
MdlNumber:
MFCD19684121
Smiles:
COC(=O)c1ccc(cc1F)OCc1ccccc1
Complexity:
289
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
Xlogp3:
3.3
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Smiles: O=C(n1nc(c2c1cc(O)cc2)I)OC(C)(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Smiles:
O=C(n1nc(c2c1cc(O)cc2)I)OC(C)(C)C
Complexity:
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__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: OC[C@H]1O[C@@H](O[C@H]2C=C3C(=O)O[C@@H](C[C@]3([C@H]3[C@]2(C)C(=C[C@@H](C3)O)C(=O)OC)C)c2cocc2)[C@@H]([C@H]([C@@H]1O)O)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
OC[C@H]1O[C@@H](O[C@H]2C=C3C(=O)O[C@@H](C[C@]3([C@H]3[C@]2(C)C(=C[C@@H](C3)O)C(=O)OC)C)c2cocc2)[C@@H]([C@H]([C@@H]1O)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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Smiles: FC(Oc1ccc(c(n1)Cl)N)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
FC(Oc1ccc(c(n1)Cl)N)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__