AB54750
1072951-42-8 | 2-(Methoxycarbonyl)-4-(trifluoromethyl)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AB54750
ChemicalName
2-(Methoxycarbonyl)-4-(trifluoromethyl)phenylboronic acid
CasNumber
1072951-42-8
MolecularFormula
C9H8BF3O4
MolecularWeight
247.9636
MdlNumber
MFCD11504848
Smiles
COC(=O)c1cc(ccc1B(O)O)C(F)(F)F
Complexity
282
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AB54750
ChemicalName: 2-(Methoxycarbonyl)-4-(trifluoromethyl)phenylboronic acid
CasNumber: 1072951-42-8
MolecularFormula: C9H8BF3O4
MolecularWeight: 247.9636
MdlNumber: MFCD11504848
Smiles: COC(=O)c1cc(ccc1B(O)O)C(F)(F)F
Complexity: 282
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AB54750
ChemicalName:
2-(Methoxycarbonyl)-4-(trifluoromethyl)phenylboronic acid
CasNumber:
1072951-42-8
MolecularFormula:
C9H8BF3O4
MolecularWeight:
247.9636
MdlNumber:
MFCD11504848
Smiles:
COC(=O)c1cc(ccc1B(O)O)C(F)(F)F
Complexity:
282
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: AB54751
ChemicalName: 2-(Methylthio)pyridine-3-boronic acid
CasNumber: 1072944-21-8
MolecularFormula: C6H8BNO2S
MolecularWeight: 169.0092
MdlNumber: MFCD09037488
Smiles: CSc1ncccc1B(O)O
Complexity: 125
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AB54751
ChemicalName:
2-(Methylthio)pyridine-3-boronic acid
CasNumber:
1072944-21-8
MolecularFormula:
C6H8BNO2S
MolecularWeight:
169.0092
MdlNumber:
MFCD09037488
Smiles:
CSc1ncccc1B(O)O
Complexity:
125
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccc(c(c1)B(O)O)S(=O)(=O)NCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccc(c(c1)B(O)O)S(=O)(=O)NCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AB54753
ChemicalName: 2-(Trifluoromethyl)pyridine-3-boronic acid
CasNumber: 947533-39-3
MolecularFormula: C6H5BF3NO2
MolecularWeight: 190.9156
MdlNumber: MFCD09271791
Smiles: OB(c1cccnc1C(F)(F)F)O
Complexity: 176
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 1
CatalogNumber:
AB54753
ChemicalName:
2-(Trifluoromethyl)pyridine-3-boronic acid
CasNumber:
947533-39-3
MolecularFormula:
C6H5BF3NO2
MolecularWeight:
190.9156
MdlNumber:
MFCD09271791
Smiles:
OB(c1cccnc1C(F)(F)F)O
Complexity:
176
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
1