AE34946
1256359-29-1 | 4,5-(Dimethoxycarbonyl)-2-fluorophenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AE34946
ChemicalName
4,5-(Dimethoxycarbonyl)-2-fluorophenylboronic acid, pinacol ester
CasNumber
1256359-29-1
MolecularFormula
C16H20BFO6
MolecularWeight
338.1358
MdlNumber
MFCD17926510
Smiles
COC(=O)c1cc(B2OC(C(O2)(C)C)(C)C)c(cc1C(=O)OC)F
Complexity
493
Covalently-bondedUnitCount
1
HeavyAtomCount
24
HydrogenBondAcceptorCount
7
RotatableBondCount
5
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CatalogNumber: AE34946
ChemicalName: 4,5-(Dimethoxycarbonyl)-2-fluorophenylboronic acid, pinacol ester
CasNumber: 1256359-29-1
MolecularFormula: C16H20BFO6
MolecularWeight: 338.1358
MdlNumber: MFCD17926510
Smiles: COC(=O)c1cc(B2OC(C(O2)(C)C)(C)C)c(cc1C(=O)OC)F
Complexity: 493
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 7
RotatableBondCount: 5
CatalogNumber:
AE34946
ChemicalName:
4,5-(Dimethoxycarbonyl)-2-fluorophenylboronic acid, pinacol ester
CasNumber:
1256359-29-1
MolecularFormula:
C16H20BFO6
MolecularWeight:
338.1358
MdlNumber:
MFCD17926510
Smiles:
COC(=O)c1cc(B2OC(C(O2)(C)C)(C)C)c(cc1C(=O)OC)F
Complexity:
493
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
7
RotatableBondCount:
5
CatalogNumber: AE34947
ChemicalName: 4-Amino-3-(trifluoromethoxy)phenylboronic acid, pinacol ester
CasNumber: 1256360-36-7
MolecularFormula: C13H17BF3NO3
MolecularWeight: 303.0852
MdlNumber: MFCD16996388
Smiles: Nc1ccc(cc1OC(F)(F)F)B1OC(C(O1)(C)C)(C)C
Complexity: 373
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 7
RotatableBondCount: 2
CatalogNumber:
AE34947
ChemicalName:
4-Amino-3-(trifluoromethoxy)phenylboronic acid, pinacol ester
CasNumber:
1256360-36-7
MolecularFormula:
C13H17BF3NO3
MolecularWeight:
303.0852
MdlNumber:
MFCD16996388
Smiles:
Nc1ccc(cc1OC(F)(F)F)B1OC(C(O1)(C)C)(C)C
Complexity:
373
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
7
RotatableBondCount:
2
CatalogNumber: __
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Smiles: O=C(c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)N1CCNCC1.Cl
Complexity: 425
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Smiles:
O=C(c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)N1CCNCC1.Cl
Complexity:
425
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Smiles: Brc1cc2[nH]cnc2cc1Br.Cl
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Smiles:
Brc1cc2[nH]cnc2cc1Br.Cl
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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