AI85404
914637-34-6 | 5-tert-butyl-1,3-oxazole-4-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AI85404
ChemicalName
5-tert-butyl-1,3-oxazole-4-carboxylic acid
CasNumber
914637-34-6
MolecularFormula
C8H11NO3
MolecularWeight
169.17784
MdlNumber
MFCD07376154
Smiles
OC(=O)c1ncoc1C(C)(C)C
Complexity
185
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.9
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CatalogNumber: AI85404
ChemicalName: 5-tert-butyl-1,3-oxazole-4-carboxylic acid
CasNumber: 914637-34-6
MolecularFormula: C8H11NO3
MolecularWeight: 169.17784
MdlNumber: MFCD07376154
Smiles: OC(=O)c1ncoc1C(C)(C)C
Complexity: 185
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.9
CatalogNumber:
AI85404
ChemicalName:
5-tert-butyl-1,3-oxazole-4-carboxylic acid
CasNumber:
914637-34-6
MolecularFormula:
C8H11NO3
MolecularWeight:
169.17784
MdlNumber:
MFCD07376154
Smiles:
OC(=O)c1ncoc1C(C)(C)C
Complexity:
185
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NNC(=O)c1ncoc1C(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
__
CasNumber:
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MolecularFormula:
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Smiles:
NNC(=O)c1ncoc1C(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CN(/C=C/C(=O)c1sc(nc1C)c1cccc(c1)C(F)(F)F)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CN(/C=C/C(=O)c1sc(nc1C)c1cccc(c1)C(F)(F)F)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [2H]C(C(C([2H])([2H])[2H])(NC(=O)Oc1ccccc1)[2H])([2H])[2H]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[2H]C(C(C([2H])([2H])[2H])(NC(=O)Oc1ccccc1)[2H])([2H])[2H]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__