AF28353
22367-82-4 | Ethyl 3-methylbenzofuran-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AF28353
ChemicalName
Ethyl 3-methylbenzofuran-2-carboxylate
CasNumber
22367-82-4
MolecularFormula
C12H12O3
MolecularWeight
204.2219
MdlNumber
MFCD00846334
Smiles
CCOC(=O)c1oc2c(c1C)cccc2
Complexity
239
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
3.2
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CatalogNumber: AF28353
ChemicalName: Ethyl 3-methylbenzofuran-2-carboxylate
CasNumber: 22367-82-4
MolecularFormula: C12H12O3
MolecularWeight: 204.2219
MdlNumber: MFCD00846334
Smiles: CCOC(=O)c1oc2c(c1C)cccc2
Complexity: 239
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 3.2
CatalogNumber:
AF28353
ChemicalName:
Ethyl 3-methylbenzofuran-2-carboxylate
CasNumber:
22367-82-4
MolecularFormula:
C12H12O3
MolecularWeight:
204.2219
MdlNumber:
MFCD00846334
Smiles:
CCOC(=O)c1oc2c(c1C)cccc2
Complexity:
239
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: COc1ccc(cc1)CC(N(CCCCOC(=O)c1ccc(c(c1)OC)OC)CC)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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MolecularFormula:
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MolecularWeight:
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Smiles:
COc1ccc(cc1)CC(N(CCCCOC(=O)c1ccc(c(c1)OC)OC)CC)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: Clc1ccc(cc1)C(=O)OC[C@H]1O[C@@H](C[C@@H]1OC(=O)c1ccc(cc1)Cl)Cl
Complexity: 516
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 5.4
CatalogNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
Clc1ccc(cc1)C(=O)OC[C@H]1O[C@@H](C[C@@H]1OC(=O)c1ccc(cc1)Cl)Cl
Complexity:
516
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
5.4
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: FC(c1ccc(cc1)c1ccncc1)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
FC(c1ccc(cc1)c1ccncc1)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__