AC98946
936250-20-3 | 5-Methylpyrazole-4-boronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AC98946
ChemicalName
5-Methylpyrazole-4-boronic acid, pinacol ester
CasNumber
936250-20-3
MolecularFormula
C10H17BN2O2
MolecularWeight
208.0652
MdlNumber
MFCD08690235
Smiles
Cc1n[nH]cc1B1OC(C(O1)(C)C)(C)C
Complexity
242
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
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CatalogNumber: AC98946
ChemicalName: 5-Methylpyrazole-4-boronic acid, pinacol ester
CasNumber: 936250-20-3
MolecularFormula: C10H17BN2O2
MolecularWeight: 208.0652
MdlNumber: MFCD08690235
Smiles: Cc1n[nH]cc1B1OC(C(O1)(C)C)(C)C
Complexity: 242
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
CatalogNumber:
AC98946
ChemicalName:
5-Methylpyrazole-4-boronic acid, pinacol ester
CasNumber:
936250-20-3
MolecularFormula:
C10H17BN2O2
MolecularWeight:
208.0652
MdlNumber:
MFCD08690235
Smiles:
Cc1n[nH]cc1B1OC(C(O1)(C)C)(C)C
Complexity:
242
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: COC(=O)c1ccc(cc1)c1c[nH]c(=O)[nH]1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
COC(=O)c1ccc(cc1)c1c[nH]c(=O)[nH]1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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MolecularFormula: __
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Smiles: COC[C@@H]1CC[C@H](N1)COC
Complexity: __
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CasNumber:
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MolecularFormula:
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Smiles:
COC[C@@H]1CC[C@H](N1)COC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)CCCCCCCO[C@@H]1OC(COC(=O)C)[C@@H](C(C1OC(=O)C)OC(=O)C)OC(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)CCCCCCCO[C@@H]1OC(COC(=O)C)[C@@H](C(C1OC(=O)C)OC(=O)C)OC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__