AB63439
400727-57-3 | 4-(N,N-Dimethylaminocarbonyl)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AB63439
ChemicalName
4-(N,N-Dimethylaminocarbonyl)phenylboronic acid, pinacol ester
CasNumber
400727-57-3
MolecularFormula
C15H22BNO3
MolecularWeight
275.1511
MdlNumber
MFCD05863908
Smiles
CN(C(=O)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Complexity
357
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
3
RotatableBondCount
2
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CatalogNumber: AB63439
ChemicalName: 4-(N,N-Dimethylaminocarbonyl)phenylboronic acid, pinacol ester
CasNumber: 400727-57-3
MolecularFormula: C15H22BNO3
MolecularWeight: 275.1511
MdlNumber: MFCD05863908
Smiles: CN(C(=O)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Complexity: 357
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
CatalogNumber:
AB63439
ChemicalName:
4-(N,N-Dimethylaminocarbonyl)phenylboronic acid, pinacol ester
CasNumber:
400727-57-3
MolecularFormula:
C15H22BNO3
MolecularWeight:
275.1511
MdlNumber:
MFCD05863908
Smiles:
CN(C(=O)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Complexity:
357
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
CatalogNumber: AB63440
ChemicalName: 3-(N,N-Dimethylsulfamoyl)phenylboronic acid, pinacol ester
CasNumber: 486422-05-3
MolecularFormula: C14H22BNO4S
MolecularWeight: 311.2048
MdlNumber: MFCD07368237
Smiles: CN(S(=O)(=O)c1cccc(c1)B1OC(C(O1)(C)C)(C)C)C
Complexity: 468
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
CatalogNumber:
AB63440
ChemicalName:
3-(N,N-Dimethylsulfamoyl)phenylboronic acid, pinacol ester
CasNumber:
486422-05-3
MolecularFormula:
C14H22BNO4S
MolecularWeight:
311.2048
MdlNumber:
MFCD07368237
Smiles:
CN(S(=O)(=O)c1cccc(c1)B1OC(C(O1)(C)C)(C)C)C
Complexity:
468
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
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Smiles: CON(C(=O)c1cccc(c1)B1OC(C(O1)(C)C)(C)C)C
Complexity: __
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Smiles:
CON(C(=O)c1cccc(c1)B1OC(C(O1)(C)C)(C)C)C
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Smiles: CCCCNCCC#N
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Smiles:
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