AD94691
850589-55-8 | 3-Fluoro-5-(2,2,2-trifluoroethoxy)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AD94691
ChemicalName
3-Fluoro-5-(2,2,2-trifluoroethoxy)phenylboronic acid
CasNumber
850589-55-8
MolecularFormula
C8H7BF4O3
MolecularWeight
237.944
MdlNumber
MFCD09475814
Smiles
Fc1cc(OCC(F)(F)F)cc(c1)B(O)O
Complexity
224
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AD94691
ChemicalName: 3-Fluoro-5-(2,2,2-trifluoroethoxy)phenylboronic acid
CasNumber: 850589-55-8
MolecularFormula: C8H7BF4O3
MolecularWeight: 237.944
MdlNumber: MFCD09475814
Smiles: Fc1cc(OCC(F)(F)F)cc(c1)B(O)O
Complexity: 224
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AD94691
ChemicalName:
3-Fluoro-5-(2,2,2-trifluoroethoxy)phenylboronic acid
CasNumber:
850589-55-8
MolecularFormula:
C8H7BF4O3
MolecularWeight:
237.944
MdlNumber:
MFCD09475814
Smiles:
Fc1cc(OCC(F)(F)F)cc(c1)B(O)O
Complexity:
224
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: AD94692
ChemicalName: 3-Chloro-4-(N,N-dimethylcarbamoyl)phenylboronic acid
CasNumber: 850589-47-8
MolecularFormula: C9H11BClNO3
MolecularWeight: 227.4525
MdlNumber: MFCD07363772
Smiles: CN(C(=O)c1ccc(cc1Cl)B(O)O)C
Complexity: 237
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AD94692
ChemicalName:
3-Chloro-4-(N,N-dimethylcarbamoyl)phenylboronic acid
CasNumber:
850589-47-8
MolecularFormula:
C9H11BClNO3
MolecularWeight:
227.4525
MdlNumber:
MFCD07363772
Smiles:
CN(C(=O)c1ccc(cc1Cl)B(O)O)C
Complexity:
237
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
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Smiles: CNc1cnco1.Cl
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CNc1cnco1.Cl
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Smiles: CCCCC(CC(C(=O)[O-])SCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)CC
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Smiles:
CCCCC(CC(C(=O)[O-])SCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)CC
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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