AC79661
72030-87-6 | Ethyl 5-(4-nitrophenyl)oxazole-4-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AC79661
ChemicalName
Ethyl 5-(4-nitrophenyl)oxazole-4-carboxylate
CasNumber
72030-87-6
MolecularFormula
C12H10N2O5
MolecularWeight
262.2182
MdlNumber
MFCD02179429
Smiles
CCOC(=O)c1ncoc1c1ccc(cc1)[N+](=O)[O-]
Complexity
336
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
6
RotatableBondCount
4
Xlogp3
2.4
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CatalogNumber: AC79661
ChemicalName: Ethyl 5-(4-nitrophenyl)oxazole-4-carboxylate
CasNumber: 72030-87-6
MolecularFormula: C12H10N2O5
MolecularWeight: 262.2182
MdlNumber: MFCD02179429
Smiles: CCOC(=O)c1ncoc1c1ccc(cc1)[N+](=O)[O-]
Complexity: 336
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 6
RotatableBondCount: 4
Xlogp3: 2.4
CatalogNumber:
AC79661
ChemicalName:
Ethyl 5-(4-nitrophenyl)oxazole-4-carboxylate
CasNumber:
72030-87-6
MolecularFormula:
C12H10N2O5
MolecularWeight:
262.2182
MdlNumber:
MFCD02179429
Smiles:
CCOC(=O)c1ncoc1c1ccc(cc1)[N+](=O)[O-]
Complexity:
336
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
6
RotatableBondCount:
4
Xlogp3:
2.4
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Smiles: Cc1c(CC(=O)OCC)c2c([nH]1)ccc(c2)Br
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Smiles:
Cc1c(CC(=O)OCC)c2c([nH]1)ccc(c2)Br
Complexity:
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Smiles: O=C1CCCC2=C1C(c1ccccc1)C1=C(N2)CCCC1=O
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Smiles:
O=C1CCCC2=C1C(c1ccccc1)C1=C(N2)CCCC1=O
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HeavyAtomCount:
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Smiles: CCCCOCCN(c1ccc(c(c1)NC(=O)C)N=Nc1ncc(s1)[N+](=O)[O-])CCOCCCC
Complexity: __
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Smiles:
CCCCOCCN(c1ccc(c(c1)NC(=O)C)N=Nc1ncc(s1)[N+](=O)[O-])CCOCCCC
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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