AA20167
1150271-57-0 | 2-Acetamido-4-(trifluoromethyl)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AA20167
ChemicalName
2-Acetamido-4-(trifluoromethyl)phenylboronic acid, pinacol ester
CasNumber
1150271-57-0
MolecularFormula
C15H19BF3NO3
MolecularWeight
329.1225
MdlNumber
MFCD12026072
Smiles
CC(=O)Nc1cc(ccc1B1OC(C(O1)(C)C)(C)C)C(F)(F)F
Complexity
451
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
2
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CatalogNumber: AA20167
ChemicalName: 2-Acetamido-4-(trifluoromethyl)phenylboronic acid, pinacol ester
CasNumber: 1150271-57-0
MolecularFormula: C15H19BF3NO3
MolecularWeight: 329.1225
MdlNumber: MFCD12026072
Smiles: CC(=O)Nc1cc(ccc1B1OC(C(O1)(C)C)(C)C)C(F)(F)F
Complexity: 451
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AA20167
ChemicalName:
2-Acetamido-4-(trifluoromethyl)phenylboronic acid, pinacol ester
CasNumber:
1150271-57-0
MolecularFormula:
C15H19BF3NO3
MolecularWeight:
329.1225
MdlNumber:
MFCD12026072
Smiles:
CC(=O)Nc1cc(ccc1B1OC(C(O1)(C)C)(C)C)C(F)(F)F
Complexity:
451
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)Nc1cc(ccc1B1OC(C(O1)(C)C)(C)C)OC(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)Nc1cc(ccc1B1OC(C(O1)(C)C)(C)C)OC(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AA20170
ChemicalName: 5-Bromo-2,3-methylenedioxyphenylboronic acid pinacol ester
CasNumber: 1150271-54-7
MolecularFormula: C13H16BBrO4
MolecularWeight: 326.9787
MdlNumber: MFCD11855972
Smiles: Brc1cc(B2OC(C(O2)(C)C)(C)C)c2c(c1)OCO2
Complexity: 347
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 1
CatalogNumber:
AA20170
ChemicalName:
5-Bromo-2,3-methylenedioxyphenylboronic acid pinacol ester
CasNumber:
1150271-54-7
MolecularFormula:
C13H16BBrO4
MolecularWeight:
326.9787
MdlNumber:
MFCD11855972
Smiles:
Brc1cc(B2OC(C(O2)(C)C)(C)C)c2c(c1)OCO2
Complexity:
347
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC1(C)OB(OC1(C)C)c1ccccc1CNCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC1(C)OB(OC1(C)C)c1ccccc1CNCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__