AB65734
1073372-03-8 | 5-Methyl-6-morpholinylpyridine-3-boronic acid pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AB65734
ChemicalName
5-Methyl-6-morpholinylpyridine-3-boronic acid pinacol ester
CasNumber
1073372-03-8
MolecularFormula
C16H25BN2O3
MolecularWeight
304.1923
MdlNumber
MFCD09037483
Smiles
Cc1cc(cnc1N1CCOCC1)B1OC(C(O1)(C)C)(C)C
Complexity
383
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
5
RotatableBondCount
2
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CatalogNumber: AB65734
ChemicalName: 5-Methyl-6-morpholinylpyridine-3-boronic acid pinacol ester
CasNumber: 1073372-03-8
MolecularFormula: C16H25BN2O3
MolecularWeight: 304.1923
MdlNumber: MFCD09037483
Smiles: Cc1cc(cnc1N1CCOCC1)B1OC(C(O1)(C)C)(C)C
Complexity: 383
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
CatalogNumber:
AB65734
ChemicalName:
5-Methyl-6-morpholinylpyridine-3-boronic acid pinacol ester
CasNumber:
1073372-03-8
MolecularFormula:
C16H25BN2O3
MolecularWeight:
304.1923
MdlNumber:
MFCD09037483
Smiles:
Cc1cc(cnc1N1CCOCC1)B1OC(C(O1)(C)C)(C)C
Complexity:
383
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
CatalogNumber: AB65735
ChemicalName: 4-(3-Methyl-5-oxo-2-pyrazolin-1-yl)benzoic acid
CasNumber: 60875-16-3
MolecularFormula: C11H10N2O3
MolecularWeight: 218.2087
MdlNumber: MFCD00003135
Smiles: OC(=O)c1ccc(cc1)N1N=C(CC1=O)C
Complexity: 343
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
CatalogNumber:
AB65735
ChemicalName:
4-(3-Methyl-5-oxo-2-pyrazolin-1-yl)benzoic acid
CasNumber:
60875-16-3
MolecularFormula:
C11H10N2O3
MolecularWeight:
218.2087
MdlNumber:
MFCD00003135
Smiles:
OC(=O)c1ccc(cc1)N1N=C(CC1=O)C
Complexity:
343
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
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Smiles: Cc1cccc(c1)OC1CCNCC1
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Cc1cccc(c1)OC1CCNCC1
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Smiles: [O-][N+](=O)c1cccc(c1)c1csc(n1)C(=O)O
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Smiles:
[O-][N+](=O)c1cccc(c1)c1csc(n1)C(=O)O
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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