AB56764
957061-08-4 | 4-(2-Hydroxy-3-(piperidin-1-yl)propoxy)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AB56764
ChemicalName
4-(2-Hydroxy-3-(piperidin-1-yl)propoxy)phenylboronic acid, pinacol ester
CasNumber
957061-08-4
MolecularFormula
C20H32BNO4
MolecularWeight
361.2834
MdlNumber
MFCD09258654
Smiles
OC(CN1CCCCC1)COc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity
429
Covalently-bondedUnitCount
1
HeavyAtomCount
26
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
6
UndefinedAtomStereocenterCount
1
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CatalogNumber: AB56764
ChemicalName: 4-(2-Hydroxy-3-(piperidin-1-yl)propoxy)phenylboronic acid, pinacol ester
CasNumber: 957061-08-4
MolecularFormula: C20H32BNO4
MolecularWeight: 361.2834
MdlNumber: MFCD09258654
Smiles: OC(CN1CCCCC1)COc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 429
Covalently-bondedUnitCount: 1
HeavyAtomCount: 26
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 6
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AB56764
ChemicalName:
4-(2-Hydroxy-3-(piperidin-1-yl)propoxy)phenylboronic acid, pinacol ester
CasNumber:
957061-08-4
MolecularFormula:
C20H32BNO4
MolecularWeight:
361.2834
MdlNumber:
MFCD09258654
Smiles:
OC(CN1CCCCC1)COc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
429
Covalently-bondedUnitCount:
1
HeavyAtomCount:
26
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
6
UndefinedAtomStereocenterCount:
1
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: CC(=O)N1CCCCC1
Complexity: 106
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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Smiles:
CC(=O)N1CCCCC1
Complexity:
106
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Smiles: Cc1ccc(cc1)S(=O)(=O)n1cnc(n1)[N+](=O)[O-]
Complexity: __
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Smiles:
Cc1ccc(cc1)S(=O)(=O)n1cnc(n1)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccc(cc1)S(=O)(=O)N1CCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__