AD45388
1073353-47-5 | N-Methyl-4-benzenesulfonamideboronic acid pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AD45388
ChemicalName
N-Methyl-4-benzenesulfonamideboronic acid pinacol ester
CasNumber
1073353-47-5
MolecularFormula
C13H20BNO4S
MolecularWeight
297.1782
MdlNumber
MFCD06657895
Smiles
CNS(=O)(=O)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity
434
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
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CatalogNumber: AD45388
ChemicalName: N-Methyl-4-benzenesulfonamideboronic acid pinacol ester
CasNumber: 1073353-47-5
MolecularFormula: C13H20BNO4S
MolecularWeight: 297.1782
MdlNumber: MFCD06657895
Smiles: CNS(=O)(=O)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 434
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
CatalogNumber:
AD45388
ChemicalName:
N-Methyl-4-benzenesulfonamideboronic acid pinacol ester
CasNumber:
1073353-47-5
MolecularFormula:
C13H20BNO4S
MolecularWeight:
297.1782
MdlNumber:
MFCD06657895
Smiles:
CNS(=O)(=O)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
434
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
CatalogNumber: AD45389
ChemicalName: 3-Chloromethylphenylboronic acid pinacol ester
CasNumber: 1073353-44-2
MolecularFormula: C13H18BClO2
MolecularWeight: 252.5448
MdlNumber: MFCD11053847
Smiles: ClCc1cccc(c1)B1OC(C(O1)(C)C)(C)C
Complexity: 265
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 2
CatalogNumber:
AD45389
ChemicalName:
3-Chloromethylphenylboronic acid pinacol ester
CasNumber:
1073353-44-2
MolecularFormula:
C13H18BClO2
MolecularWeight:
252.5448
MdlNumber:
MFCD11053847
Smiles:
ClCc1cccc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
265
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][n+]1ccc(c(c1)C)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][n+]1ccc(c(c1)C)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AD45391
ChemicalName: 2,5-Dimethoxyphenylboronic acid, pinacol ester
CasNumber: 1073339-07-7
MolecularFormula: C14H21BO4
MolecularWeight: 264.1251
MdlNumber: MFCD12405521
Smiles: COc1ccc(cc1B1OC(C(O1)(C)C)(C)C)OC
Complexity: 303
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 3
CatalogNumber:
AD45391
ChemicalName:
2,5-Dimethoxyphenylboronic acid, pinacol ester
CasNumber:
1073339-07-7
MolecularFormula:
C14H21BO4
MolecularWeight:
264.1251
MdlNumber:
MFCD12405521
Smiles:
COc1ccc(cc1B1OC(C(O1)(C)C)(C)C)OC
Complexity:
303
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
3