AC64950
68716-51-8 | 3,5-Dichlorophenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AC64950
ChemicalName
3,5-Dichlorophenylboronic acid, pinacol ester
CasNumber
68716-51-8
MolecularFormula
C12H15BCl2O2
MolecularWeight
272.9633
MdlNumber
MFCD05863906
Smiles
CC1(C)OB(OC1(C)C)c1cc(Cl)cc(c1)Cl
Complexity
270
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
2
RotatableBondCount
1
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CatalogNumber: AC64950
ChemicalName: 3,5-Dichlorophenylboronic acid, pinacol ester
CasNumber: 68716-51-8
MolecularFormula: C12H15BCl2O2
MolecularWeight: 272.9633
MdlNumber: MFCD05863906
Smiles: CC1(C)OB(OC1(C)C)c1cc(Cl)cc(c1)Cl
Complexity: 270
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
CatalogNumber:
AC64950
ChemicalName:
3,5-Dichlorophenylboronic acid, pinacol ester
CasNumber:
68716-51-8
MolecularFormula:
C12H15BCl2O2
MolecularWeight:
272.9633
MdlNumber:
MFCD05863906
Smiles:
CC1(C)OB(OC1(C)C)c1cc(Cl)cc(c1)Cl
Complexity:
270
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
CatalogNumber: AC64951
ChemicalName: 3-Nitrophenylboronic acid, pinacol ester
CasNumber: 68716-48-3
MolecularFormula: C12H16BNO4
MolecularWeight: 249.07074000000003
MdlNumber: MFCD05663879
Smiles: O=N(=O)c1cccc(c1)B1OC(C(O1)(C)C)(C)C
Complexity: 324
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
CatalogNumber:
AC64951
ChemicalName:
3-Nitrophenylboronic acid, pinacol ester
CasNumber:
68716-48-3
MolecularFormula:
C12H16BNO4
MolecularWeight:
249.07074000000003
MdlNumber:
MFCD05663879
Smiles:
O=N(=O)c1cccc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
324
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
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Smiles: COC[C@H]1O[C@@H]2O[C@@H]3[C@@H](COC)O[C@@H]([C@@H]([C@H]3OC)OC)O[C@@H]3[C@@H](COC)O[C@@H]([C@@H]([C@H]3OC)OC)O[C@H]3[CH][CH][C@@H](O[C@@H]4[C@H](O[C@H](O[C@@H]5[C@H](O[C@H](O[C@H]1[C@@H]([C@H]2OC)OC)[C@H](OC)[C@H]5OC)COC)[C@H](OC)[C@H]4OC)COC)O[CH]3
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Smiles:
COC[C@H]1O[C@@H]2O[C@@H]3[C@@H](COC)O[C@@H]([C@@H]([C@H]3OC)OC)O[C@@H]3[C@@H](COC)O[C@@H]([C@@H]([C@H]3OC)OC)O[C@H]3[CH][CH][C@@H](O[C@@H]4[C@H](O[C@H](O[C@@H]5[C@H](O[C@H](O[C@H]1[C@@H]([C@H]2OC)OC)[C@H](OC)[C@H]5OC)COC)[C@H](OC)[C@H]4OC)COC)O[CH]3
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Smiles: CSc1nnnn1C
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Smiles:
CSc1nnnn1C
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HydrogenBondAcceptorCount:
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