AA30917
1256345-52-4 | 2-Isopropylthio-5-trifluoromethylpyridine-3-boronic acid
Manufacturer: A2B Chem
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CatalogNumber
AA30917
ChemicalName
2-Isopropylthio-5-trifluoromethylpyridine-3-boronic acid
CasNumber
1256345-52-4
MolecularFormula
C9H11BF3NO2S
MolecularWeight
265.0603
MdlNumber
MFCD16660272
Smiles
CC(Sc1ncc(cc1B(O)O)C(F)(F)F)C
Complexity
253
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AA30917
ChemicalName: 2-Isopropylthio-5-trifluoromethylpyridine-3-boronic acid
CasNumber: 1256345-52-4
MolecularFormula: C9H11BF3NO2S
MolecularWeight: 265.0603
MdlNumber: MFCD16660272
Smiles: CC(Sc1ncc(cc1B(O)O)C(F)(F)F)C
Complexity: 253
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AA30917
ChemicalName:
2-Isopropylthio-5-trifluoromethylpyridine-3-boronic acid
CasNumber:
1256345-52-4
MolecularFormula:
C9H11BF3NO2S
MolecularWeight:
265.0603
MdlNumber:
MFCD16660272
Smiles:
CC(Sc1ncc(cc1B(O)O)C(F)(F)F)C
Complexity:
253
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: AA30918
ChemicalName: 2-Chloro-3-propoxyphenylboronic acid
CasNumber: 1256345-51-3
MolecularFormula: C9H12BClO3
MolecularWeight: 214.4538
MdlNumber: MFCD16660271
Smiles: CCCOc1cccc(c1Cl)B(O)O
Complexity: 168
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AA30918
ChemicalName:
2-Chloro-3-propoxyphenylboronic acid
CasNumber:
1256345-51-3
MolecularFormula:
C9H12BClO3
MolecularWeight:
214.4538
MdlNumber:
MFCD16660271
Smiles:
CCCOc1cccc(c1Cl)B(O)O
Complexity:
168
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
4
CatalogNumber: AA30920
ChemicalName: 2-Isobutoxy-5-(trifluoromethyl)phenylboronic acid
CasNumber: 1256345-99-9
MolecularFormula: C11H14BF3O3
MolecularWeight: 262.0333
MdlNumber: MFCD16036116
Smiles: CC(COc1ccc(cc1B(O)O)C(F)(F)F)C
Complexity: 258
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AA30920
ChemicalName:
2-Isobutoxy-5-(trifluoromethyl)phenylboronic acid
CasNumber:
1256345-99-9
MolecularFormula:
C11H14BF3O3
MolecularWeight:
262.0333
MdlNumber:
MFCD16036116
Smiles:
CC(COc1ccc(cc1B(O)O)C(F)(F)F)C
Complexity:
258
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCOc1ccc(cc1B(O)O)C(F)(F)F
Complexity: 248
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCOc1ccc(cc1B(O)O)C(F)(F)F
Complexity:
248
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__