AA40955
1312312-78-9 | 1-Methyl-1H-pyrazolo[3,4-b]pyridine-5-boronic acid pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AA40955
ChemicalName
1-Methyl-1H-pyrazolo[3,4-b]pyridine-5-boronic acid pinacol ester
CasNumber
1312312-78-9
MolecularFormula
C13H18BN3O2
MolecularWeight
259.1119
MdlNumber
MFCD16995953
Smiles
Cn1ncc2c1ncc(c2)B1OC(C(O1)(C)C)(C)C
Complexity
348
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
RotatableBondCount
1
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CatalogNumber: AA40955
ChemicalName: 1-Methyl-1H-pyrazolo[3,4-b]pyridine-5-boronic acid pinacol ester
CasNumber: 1312312-78-9
MolecularFormula: C13H18BN3O2
MolecularWeight: 259.1119
MdlNumber: MFCD16995953
Smiles: Cn1ncc2c1ncc(c2)B1OC(C(O1)(C)C)(C)C
Complexity: 348
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
CatalogNumber:
AA40955
ChemicalName:
1-Methyl-1H-pyrazolo[3,4-b]pyridine-5-boronic acid pinacol ester
CasNumber:
1312312-78-9
MolecularFormula:
C13H18BN3O2
MolecularWeight:
259.1119
MdlNumber:
MFCD16995953
Smiles:
Cn1ncc2c1ncc(c2)B1OC(C(O1)(C)C)(C)C
Complexity:
348
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
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Smiles: [N-]=[N+]=NCCOCCOCCC(=O)ON1C(=O)CCC1=O
Complexity: __
Covalently-bondedUnitCount: __
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Smiles:
[N-]=[N+]=NCCOCCOCCC(=O)ON1C(=O)CCC1=O
Complexity:
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HydrogenBondAcceptorCount:
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Smiles: C=CC[C@@H](C(=O)Cl)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity: __
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MolecularFormula:
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Smiles:
C=CC[C@@H](C(=O)Cl)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: O=Cc1cccc(c1)c1cccnc1
Complexity: 193
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=Cc1cccc(c1)c1cccnc1
Complexity:
193
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__