AC94036
914220-30-7 | 5-(4-Nitrophenyl)oxazole-4-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AC94036
ChemicalName
5-(4-Nitrophenyl)oxazole-4-carboxylic acid
CasNumber
914220-30-7
MolecularFormula
C10H6N2O5
MolecularWeight
234.165
MdlNumber
MFCD08558969
Smiles
[O-][N+](=O)c1ccc(cc1)c1ocnc1C(=O)O
Complexity
308
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.7
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CatalogNumber: AC94036
ChemicalName: 5-(4-Nitrophenyl)oxazole-4-carboxylic acid
CasNumber: 914220-30-7
MolecularFormula: C10H6N2O5
MolecularWeight: 234.165
MdlNumber: MFCD08558969
Smiles: [O-][N+](=O)c1ccc(cc1)c1ocnc1C(=O)O
Complexity: 308
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.7
CatalogNumber:
AC94036
ChemicalName:
5-(4-Nitrophenyl)oxazole-4-carboxylic acid
CasNumber:
914220-30-7
MolecularFormula:
C10H6N2O5
MolecularWeight:
234.165
MdlNumber:
MFCD08558969
Smiles:
[O-][N+](=O)c1ccc(cc1)c1ocnc1C(=O)O
Complexity:
308
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.7
CatalogNumber: __
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MolecularFormula: __
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Smiles: OC(=O)c1c(Cl)ccnc1C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
OC(=O)c1c(Cl)ccnc1C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: O1C[C@H]1Cc1ccccc1
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Smiles:
O1C[C@H]1Cc1ccccc1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Clc1ncccc1C(=O)c1ccc(o1)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1ncccc1C(=O)c1ccc(o1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__