AI03350
957120-83-1 | 3-(Methylthio)-5-(trifluoromethyl)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AI03350
ChemicalName
3-(Methylthio)-5-(trifluoromethyl)phenylboronic acid
CasNumber
957120-83-1
MolecularFormula
C8H8BF3O2S
MolecularWeight
236.0191
MdlNumber
MFCD09800876
Smiles
CSc1cc(cc(c1)C(F)(F)F)B(O)O
Complexity
213
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
2
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CatalogNumber: AI03350
ChemicalName: 3-(Methylthio)-5-(trifluoromethyl)phenylboronic acid
CasNumber: 957120-83-1
MolecularFormula: C8H8BF3O2S
MolecularWeight: 236.0191
MdlNumber: MFCD09800876
Smiles: CSc1cc(cc(c1)C(F)(F)F)B(O)O
Complexity: 213
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AI03350
ChemicalName:
3-(Methylthio)-5-(trifluoromethyl)phenylboronic acid
CasNumber:
957120-83-1
MolecularFormula:
C8H8BF3O2S
MolecularWeight:
236.0191
MdlNumber:
MFCD09800876
Smiles:
CSc1cc(cc(c1)C(F)(F)F)B(O)O
Complexity:
213
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc(c(c1F)B(O)O)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc(c(c1F)B(O)O)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AI03352
ChemicalName: 5-Bromo-3-carboxy-2-fluorophenylboronic acid
CasNumber: 957120-63-7
MolecularFormula: C7H5BBrFO4
MolecularWeight: 262.8256
MdlNumber: MFCD09800869
Smiles: Brc1cc(B(O)O)c(c(c1)C(=O)O)F
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 3
RotatableBondCount: 2
CatalogNumber:
AI03352
ChemicalName:
5-Bromo-3-carboxy-2-fluorophenylboronic acid
CasNumber:
957120-63-7
MolecularFormula:
C7H5BBrFO4
MolecularWeight:
262.8256
MdlNumber:
MFCD09800869
Smiles:
Brc1cc(B(O)O)c(c(c1)C(=O)O)F
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
3
RotatableBondCount:
2
CatalogNumber: AI03353
ChemicalName: 5-Fluoro-2-methoxypyridine-3-boronic acid
CasNumber: 957120-32-0
MolecularFormula: C6H7BFNO3
MolecularWeight: 170.9341
MdlNumber: MFCD07368239
Smiles: COc1ncc(cc1B(O)O)F
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AI03353
ChemicalName:
5-Fluoro-2-methoxypyridine-3-boronic acid
CasNumber:
957120-32-0
MolecularFormula:
C6H7BFNO3
MolecularWeight:
170.9341
MdlNumber:
MFCD07368239
Smiles:
COc1ncc(cc1B(O)O)F
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
2