AA54642
1218791-44-6 | 2-Ethylaminopyrimidine-5-boronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AA54642
ChemicalName
2-Ethylaminopyrimidine-5-boronic acid, pinacol ester
CasNumber
1218791-44-6
MolecularFormula
C12H20BN3O2
MolecularWeight
249.1171
MdlNumber
MFCD12546554
Smiles
CCNc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity
275
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
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CatalogNumber: AA54642
ChemicalName: 2-Ethylaminopyrimidine-5-boronic acid, pinacol ester
CasNumber: 1218791-44-6
MolecularFormula: C12H20BN3O2
MolecularWeight: 249.1171
MdlNumber: MFCD12546554
Smiles: CCNc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity: 275
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
CatalogNumber:
AA54642
ChemicalName:
2-Ethylaminopyrimidine-5-boronic acid, pinacol ester
CasNumber:
1218791-44-6
MolecularFormula:
C12H20BN3O2
MolecularWeight:
249.1171
MdlNumber:
MFCD12546554
Smiles:
CCNc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity:
275
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(Nc1ncc(cn1)B1OC(C(O1)(C)C)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(Nc1ncc(cn1)B1OC(C(O1)(C)C)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AA54644
ChemicalName: 4-Cbz-Amino-3-chlorophenylboronic acid, pinacol ester
CasNumber: 1218791-42-4
MolecularFormula: C20H23BClNO4
MolecularWeight: 387.6649
MdlNumber: MFCD12546536
Smiles: O=C(Nc1ccc(cc1Cl)B1OC(C(O1)(C)C)(C)C)OCc1ccccc1
Complexity: 508
Covalently-bondedUnitCount: 1
HeavyAtomCount: 27
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 5
CatalogNumber:
AA54644
ChemicalName:
4-Cbz-Amino-3-chlorophenylboronic acid, pinacol ester
CasNumber:
1218791-42-4
MolecularFormula:
C20H23BClNO4
MolecularWeight:
387.6649
MdlNumber:
MFCD12546536
Smiles:
O=C(Nc1ccc(cc1Cl)B1OC(C(O1)(C)C)(C)C)OCc1ccccc1
Complexity:
508
Covalently-bondedUnitCount:
1
HeavyAtomCount:
27
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
5
CatalogNumber: AA54645
ChemicalName: 2-Acetamido-5-aminophenylboronic acid, pinacol ester, HCl
CasNumber: 1218791-41-3
MolecularFormula: C14H22BClN2O3
MolecularWeight: 312.6001
MdlNumber: MFCD12546537
Smiles: CC(=O)Nc1ccc(cc1B1OC(C(O1)(C)C)(C)C)N.Cl
Complexity: 371
Covalently-bondedUnitCount: 2
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 2
CatalogNumber:
AA54645
ChemicalName:
2-Acetamido-5-aminophenylboronic acid, pinacol ester, HCl
CasNumber:
1218791-41-3
MolecularFormula:
C14H22BClN2O3
MolecularWeight:
312.6001
MdlNumber:
MFCD12546537
Smiles:
CC(=O)Nc1ccc(cc1B1OC(C(O1)(C)C)(C)C)N.Cl
Complexity:
371
Covalently-bondedUnitCount:
2
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
2