AA20196
1150271-69-4 | 2-Methyl-5-(trifluoromethylsulfonyl)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AA20196
ChemicalName
2-Methyl-5-(trifluoromethylsulfonyl)phenylboronic acid, pinacol ester
CasNumber
1150271-69-4
MolecularFormula
C14H18BF3O4S
MolecularWeight
350.1615
MdlNumber
MFCD12026078
Smiles
Cc1ccc(cc1B1OC(C(O1)(C)C)(C)C)S(=O)(=O)C(F)(F)F
Complexity
537
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
7
RotatableBondCount
2
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CatalogNumber: AA20196
ChemicalName: 2-Methyl-5-(trifluoromethylsulfonyl)phenylboronic acid, pinacol ester
CasNumber: 1150271-69-4
MolecularFormula: C14H18BF3O4S
MolecularWeight: 350.1615
MdlNumber: MFCD12026078
Smiles: Cc1ccc(cc1B1OC(C(O1)(C)C)(C)C)S(=O)(=O)C(F)(F)F
Complexity: 537
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 7
RotatableBondCount: 2
CatalogNumber:
AA20196
ChemicalName:
2-Methyl-5-(trifluoromethylsulfonyl)phenylboronic acid, pinacol ester
CasNumber:
1150271-69-4
MolecularFormula:
C14H18BF3O4S
MolecularWeight:
350.1615
MdlNumber:
MFCD12026078
Smiles:
Cc1ccc(cc1B1OC(C(O1)(C)C)(C)C)S(=O)(=O)C(F)(F)F
Complexity:
537
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
7
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)Cc1cc(B2OC(C(O2)(C)C)(C)C)c2c(c1)OCO2
Complexity: 450
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)Cc1cc(B2OC(C(O2)(C)C)(C)C)c2c(c1)OCO2
Complexity:
450
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)Nc1cc(F)ccc1B1OC(C(O1)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CC(=O)Nc1cc(F)ccc1B1OC(C(O1)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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CatalogNumber: AA20199
ChemicalName: 4-Acetamido-3-(trifluoromethy)phenylboronic acid, pinacol ester
CasNumber: 1150271-66-1
MolecularFormula: C15H19BF3NO3
MolecularWeight: 329.1225
MdlNumber: MFCD11855983
Smiles: CC(=O)Nc1ccc(cc1C(F)(F)F)B1OC(C(O1)(C)C)(C)C
Complexity: 451
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 6
RotatableBondCount: 2
CatalogNumber:
AA20199
ChemicalName:
4-Acetamido-3-(trifluoromethy)phenylboronic acid, pinacol ester
CasNumber:
1150271-66-1
MolecularFormula:
C15H19BF3NO3
MolecularWeight:
329.1225
MdlNumber:
MFCD11855983
Smiles:
CC(=O)Nc1ccc(cc1C(F)(F)F)B1OC(C(O1)(C)C)(C)C
Complexity:
451
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
6
RotatableBondCount:
2