AA80701
159013-94-2 | Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA80701
ChemicalName
Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate
CasNumber
159013-94-2
MolecularFormula
C4H5N3O3
MolecularWeight
143.1008
MdlNumber
MFCD00465007
Smiles
COC(=O)c1nonc1N
Complexity
140
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
0.1
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CatalogNumber: AA80701
ChemicalName: Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate
CasNumber: 159013-94-2
MolecularFormula: C4H5N3O3
MolecularWeight: 143.1008
MdlNumber: MFCD00465007
Smiles: COC(=O)c1nonc1N
Complexity: 140
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.1
CatalogNumber:
AA80701
ChemicalName:
Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate
CasNumber:
159013-94-2
MolecularFormula:
C4H5N3O3
MolecularWeight:
143.1008
MdlNumber:
MFCD00465007
Smiles:
COC(=O)c1nonc1N
Complexity:
140
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.1
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Smiles: Ic1nonc1N
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
Ic1nonc1N
Complexity:
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RotatableBondCount:
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Smiles: Brc1ccc(s1)CC=C
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Smiles:
Brc1ccc(s1)CC=C
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HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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__
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Smiles: CCN(CCS(=O)(=O)O)CC
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCN(CCS(=O)(=O)O)CC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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