AA54517
1218790-13-6 | 4-Chloro-5-cyano-2-fluorophenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AA54517
ChemicalName
4-Chloro-5-cyano-2-fluorophenylboronic acid, pinacol ester
CasNumber
1218790-13-6
MolecularFormula
C13H14BClFNO2
MolecularWeight
281.5182
MdlNumber
MFCD13195765
Smiles
N#Cc1cc(B2OC(C(O2)(C)C)(C)C)c(cc1Cl)F
Complexity
393
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
RotatableBondCount
1
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CatalogNumber: AA54517
ChemicalName: 4-Chloro-5-cyano-2-fluorophenylboronic acid, pinacol ester
CasNumber: 1218790-13-6
MolecularFormula: C13H14BClFNO2
MolecularWeight: 281.5182
MdlNumber: MFCD13195765
Smiles: N#Cc1cc(B2OC(C(O2)(C)C)(C)C)c(cc1Cl)F
Complexity: 393
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
CatalogNumber:
AA54517
ChemicalName:
4-Chloro-5-cyano-2-fluorophenylboronic acid, pinacol ester
CasNumber:
1218790-13-6
MolecularFormula:
C13H14BClFNO2
MolecularWeight:
281.5182
MdlNumber:
MFCD13195765
Smiles:
N#Cc1cc(B2OC(C(O2)(C)C)(C)C)c(cc1Cl)F
Complexity:
393
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(Nc1cncc(c1)B1OC(C(O1)(C)C)(C)C)OCc1ccccc1
Complexity: 478
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(Nc1cncc(c1)B1OC(C(O1)(C)C)(C)C)OCc1ccccc1
Complexity:
478
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC1(C)OB(OC1(C)C)[C@@H]1CCCC[C@H]1B1OC(C(O1)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC1(C)OB(OC1(C)C)[C@@H]1CCCC[C@H]1B1OC(C(O1)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: AA54520
ChemicalName: 4-Benzyloxy-2-trifluoromethylphenylboronic acid pinacol ester
CasNumber: 1218790-07-8
MolecularFormula: C20H22BF3O3
MolecularWeight: 378.1931
MdlNumber: MFCD13195761
Smiles: CC1(C)OB(OC1(C)C)c1ccc(cc1C(F)(F)F)OCc1ccccc1
Complexity: 487
Covalently-bondedUnitCount: 1
HeavyAtomCount: 27
HydrogenBondAcceptorCount: 6
RotatableBondCount: 4
CatalogNumber:
AA54520
ChemicalName:
4-Benzyloxy-2-trifluoromethylphenylboronic acid pinacol ester
CasNumber:
1218790-07-8
MolecularFormula:
C20H22BF3O3
MolecularWeight:
378.1931
MdlNumber:
MFCD13195761
Smiles:
CC1(C)OB(OC1(C)C)c1ccc(cc1C(F)(F)F)OCc1ccccc1
Complexity:
487
Covalently-bondedUnitCount:
1
HeavyAtomCount:
27
HydrogenBondAcceptorCount:
6
RotatableBondCount:
4