AB09616
200400-76-6 | Ethyl 2-(4'-hydroxyphenyl)-1,3-oxazole-4-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB09616
ChemicalName
Ethyl 2-(4'-hydroxyphenyl)-1,3-oxazole-4-carboxylate
CasNumber
200400-76-6
MolecularFormula
C12H11NO4
MolecularWeight
233.22
MdlNumber
MFCD02183587
Smiles
CCOC(=O)c1coc(n1)c1ccc(cc1)O
Complexity
263
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
2.2
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CatalogNumber: AB09616
ChemicalName: Ethyl 2-(4'-hydroxyphenyl)-1,3-oxazole-4-carboxylate
CasNumber: 200400-76-6
MolecularFormula: C12H11NO4
MolecularWeight: 233.22
MdlNumber: MFCD02183587
Smiles: CCOC(=O)c1coc(n1)c1ccc(cc1)O
Complexity: 263
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 2.2
CatalogNumber:
AB09616
ChemicalName:
Ethyl 2-(4'-hydroxyphenyl)-1,3-oxazole-4-carboxylate
CasNumber:
200400-76-6
MolecularFormula:
C12H11NO4
MolecularWeight:
233.22
MdlNumber:
MFCD02183587
Smiles:
CCOC(=O)c1coc(n1)c1ccc(cc1)O
Complexity:
263
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
2.2
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Smiles: O=C([C@H](NC(=O)OC(C)(C)C)CCC(=O)OC(C)(C)C)Oc1ccc(cc1)[N+](=O)[O-]
Complexity: __
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HeavyAtomCount: __
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HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
O=C([C@H](NC(=O)OC(C)(C)C)CCC(=O)OC(C)(C)C)Oc1ccc(cc1)[N+](=O)[O-]
Complexity:
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Smiles: C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C1SCC(O1)O)C(C)C
Complexity: __
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Smiles:
C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C1SCC(O1)O)C(C)C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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RotatableBondCount:
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Xlogp3:
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MolecularWeight: __
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Smiles: O=C(N[C@@H](C(=O)Oc1c(F)c(F)c(c(c1F)F)F)CSC(c1ccccc1)(c1ccccc1)c1ccccc1)OCC1c2ccccc2-c2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N[C@@H](C(=O)Oc1c(F)c(F)c(c(c1F)F)F)CSC(c1ccccc1)(c1ccccc1)c1ccccc1)OCC1c2ccccc2-c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__