AE31814
1105039-88-0 | 1-(4-Methoxybenzyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazole
Manufacturer: A2B Chem
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CatalogNumber
AE31814
ChemicalName
1-(4-Methoxybenzyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazole
CasNumber
1105039-88-0
MolecularFormula
C17H23BN2O3
MolecularWeight
314.1871
MdlNumber
MFCD16877287
Smiles
COc1ccc(cc1)Cn1ncc(c1)B1OC(C(O1)(C)C)(C)C
Complexity
395
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
4
RotatableBondCount
4
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CatalogNumber: AE31814
ChemicalName: 1-(4-Methoxybenzyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazole
CasNumber: 1105039-88-0
MolecularFormula: C17H23BN2O3
MolecularWeight: 314.1871
MdlNumber: MFCD16877287
Smiles: COc1ccc(cc1)Cn1ncc(c1)B1OC(C(O1)(C)C)(C)C
Complexity: 395
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
CatalogNumber:
AE31814
ChemicalName:
1-(4-Methoxybenzyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazole
CasNumber:
1105039-88-0
MolecularFormula:
C17H23BN2O3
MolecularWeight:
314.1871
MdlNumber:
MFCD16877287
Smiles:
COc1ccc(cc1)Cn1ncc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
395
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
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Smiles: N[C@@H]([C@@H](c1ccccc1)NS(=O)(=O)c1ccc(cc1)C(F)(F)F)c1ccccc1
Complexity: __
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Smiles:
N[C@@H]([C@@H](c1ccccc1)NS(=O)(=O)c1ccc(cc1)C(F)(F)F)c1ccccc1
Complexity:
__
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Smiles: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CN=C2)C3=CC=C(C=C3)F
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Smiles:
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CN=C2)C3=CC=C(C=C3)F
Complexity:
__
Covalently-bondedUnitCount:
__
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Smiles: Cc1ccc(cc1)S(=O)(=O)O.CCOC(=O)[C@H]1CCCC[C@H]1N[C@@H](c1ccccc1)C
Complexity: __
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CatalogNumber:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
Cc1ccc(cc1)S(=O)(=O)O.CCOC(=O)[C@H]1CCCC[C@H]1N[C@@H](c1ccccc1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__