AC95008
957061-20-0 | 4-(2-(1H-Pyrazol-1-yl)ethoxy)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AC95008
ChemicalName
4-(2-(1H-Pyrazol-1-yl)ethoxy)phenylboronic acid, pinacol ester
CasNumber
957061-20-0
MolecularFormula
C17H23BN2O3
MolecularWeight
314.1871
MdlNumber
MFCD09258658
Smiles
CC1(C)OB(OC1(C)C)c1ccc(cc1)OCCn1cccn1
Complexity
381
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
4
RotatableBondCount
5
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CatalogNumber: AC95008
ChemicalName: 4-(2-(1H-Pyrazol-1-yl)ethoxy)phenylboronic acid, pinacol ester
CasNumber: 957061-20-0
MolecularFormula: C17H23BN2O3
MolecularWeight: 314.1871
MdlNumber: MFCD09258658
Smiles: CC1(C)OB(OC1(C)C)c1ccc(cc1)OCCn1cccn1
Complexity: 381
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
CatalogNumber:
AC95008
ChemicalName:
4-(2-(1H-Pyrazol-1-yl)ethoxy)phenylboronic acid, pinacol ester
CasNumber:
957061-20-0
MolecularFormula:
C17H23BN2O3
MolecularWeight:
314.1871
MdlNumber:
MFCD09258658
Smiles:
CC1(C)OB(OC1(C)C)c1ccc(cc1)OCCn1cccn1
Complexity:
381
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
CatalogNumber: AC95009
ChemicalName: 3-Chloro-4-(cyclopentylcarbamoyl)phenylboronic acid
CasNumber: 957061-19-7
MolecularFormula: C12H15BClNO3
MolecularWeight: 267.5164
MdlNumber: MFCD09258664
Smiles: O=C(c1ccc(cc1Cl)B(O)O)NC1CCCC1
Complexity: 297
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
CatalogNumber:
AC95009
ChemicalName:
3-Chloro-4-(cyclopentylcarbamoyl)phenylboronic acid
CasNumber:
957061-19-7
MolecularFormula:
C12H15BClNO3
MolecularWeight:
267.5164
MdlNumber:
MFCD09258664
Smiles:
O=C(c1ccc(cc1Cl)B(O)O)NC1CCCC1
Complexity:
297
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
CatalogNumber: AC95010
ChemicalName: N,N-Diethyl 2-boronobenzenesulfonamide
CasNumber: 957061-16-4
MolecularFormula: C10H16BNO4S
MolecularWeight: 257.1143
MdlNumber: MFCD09258634
Smiles: CCN(S(=O)(=O)c1ccccc1B(O)O)CC
Complexity: 324
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
RotatableBondCount: 5
CatalogNumber:
AC95010
ChemicalName:
N,N-Diethyl 2-boronobenzenesulfonamide
CasNumber:
957061-16-4
MolecularFormula:
C10H16BNO4S
MolecularWeight:
257.1143
MdlNumber:
MFCD09258634
Smiles:
CCN(S(=O)(=O)c1ccccc1B(O)O)CC
Complexity:
324
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
RotatableBondCount:
5
CatalogNumber: AC95011
ChemicalName: 5-Bromo-2-fluoro-4-methylphenylboronic acid
CasNumber: 957061-14-2
MolecularFormula: C7H7BBrFO2
MolecularWeight: 232.8427
MdlNumber: MFCD09258744
Smiles: OB(c1cc(Br)c(cc1F)C)O
Complexity: 158
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
CatalogNumber:
AC95011
ChemicalName:
5-Bromo-2-fluoro-4-methylphenylboronic acid
CasNumber:
957061-14-2
MolecularFormula:
C7H7BBrFO2
MolecularWeight:
232.8427
MdlNumber:
MFCD09258744
Smiles:
OB(c1cc(Br)c(cc1F)C)O
Complexity:
158
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1