AC32068
850567-59-8 | 4-(3-Butylureido)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AC32068
ChemicalName
4-(3-Butylureido)phenylboronic acid, pinacol ester
CasNumber
850567-59-8
MolecularFormula
C17H27BN2O3
MolecularWeight
318.2189
MdlNumber
MFCD07363843
Smiles
CCCCNC(=O)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity
391
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
5
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CatalogNumber: AC32068
ChemicalName: 4-(3-Butylureido)phenylboronic acid, pinacol ester
CasNumber: 850567-59-8
MolecularFormula: C17H27BN2O3
MolecularWeight: 318.2189
MdlNumber: MFCD07363843
Smiles: CCCCNC(=O)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 391
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 5
CatalogNumber:
AC32068
ChemicalName:
4-(3-Butylureido)phenylboronic acid, pinacol ester
CasNumber:
850567-59-8
MolecularFormula:
C17H27BN2O3
MolecularWeight:
318.2189
MdlNumber:
MFCD07363843
Smiles:
CCCCNC(=O)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
391
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
5
CatalogNumber: AC32069
ChemicalName: 3-(4-Fluorophenyl)aminocarbonylphenylboronic acid, pinacol ester
CasNumber: 850567-58-7
MolecularFormula: C19H21BFNO3
MolecularWeight: 341.1843
MdlNumber: MFCD06659930
Smiles: Fc1ccc(cc1)NC(=O)c1cccc(c1)B1OC(C(O1)(C)C)(C)C
Complexity: 475
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
CatalogNumber:
AC32069
ChemicalName:
3-(4-Fluorophenyl)aminocarbonylphenylboronic acid, pinacol ester
CasNumber:
850567-58-7
MolecularFormula:
C19H21BFNO3
MolecularWeight:
341.1843
MdlNumber:
MFCD06659930
Smiles:
Fc1ccc(cc1)NC(=O)c1cccc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
475
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
CatalogNumber: AC32070
ChemicalName: 3-Amino-4-methylphenylboronic acid, pinacol ester, HCl
CasNumber: 850567-52-1
MolecularFormula: C13H21BClNO2
MolecularWeight: 269.5753
MdlNumber: MFCD06659921
Smiles: Cc1ccc(cc1N)B1OC(C(O1)(C)C)(C)C.Cl
Complexity: 277
Covalently-bondedUnitCount: 2
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
CatalogNumber:
AC32070
ChemicalName:
3-Amino-4-methylphenylboronic acid, pinacol ester, HCl
CasNumber:
850567-52-1
MolecularFormula:
C13H21BClNO2
MolecularWeight:
269.5753
MdlNumber:
MFCD06659921
Smiles:
Cc1ccc(cc1N)B1OC(C(O1)(C)C)(C)C.Cl
Complexity:
277
Covalently-bondedUnitCount:
2
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
CatalogNumber: AC32071
ChemicalName: 2-Amino-4-methoxycarbonylphenylboronic acid, pinacol ester, HCl
CasNumber: 850567-49-6
MolecularFormula: C14H21BClNO4
MolecularWeight: 313.5848
MdlNumber: MFCD06659918
Smiles: COC(=O)c1ccc(c(c1)N)B1OC(C(O1)(C)C)(C)C.Cl
Complexity: 369
Covalently-bondedUnitCount: 2
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AC32071
ChemicalName:
2-Amino-4-methoxycarbonylphenylboronic acid, pinacol ester, HCl
CasNumber:
850567-49-6
MolecularFormula:
C14H21BClNO4
MolecularWeight:
313.5848
MdlNumber:
MFCD06659918
Smiles:
COC(=O)c1ccc(c(c1)N)B1OC(C(O1)(C)C)(C)C.Cl
Complexity:
369
Covalently-bondedUnitCount:
2
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3