AA55178
1220968-24-0 | Ethyl 2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazol-1-yl)propanoate
Manufacturer: A2B Chem
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CatalogNumber
AA55178
ChemicalName
Ethyl 2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazol-1-yl)propanoate
CasNumber
1220968-24-0
MolecularFormula
C14H23BN2O4
MolecularWeight
294.1544
MdlNumber
MFCD27996757
Smiles
CCOC(=O)C(n1ncc(c1)B1OC(C(O1)(C)C)(C)C)C
Complexity
386
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
5
RotatableBondCount
5
UndefinedAtomStereocenterCount
1
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CatalogNumber: AA55178
ChemicalName: Ethyl 2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazol-1-yl)propanoate
CasNumber: 1220968-24-0
MolecularFormula: C14H23BN2O4
MolecularWeight: 294.1544
MdlNumber: MFCD27996757
Smiles: CCOC(=O)C(n1ncc(c1)B1OC(C(O1)(C)C)(C)C)C
Complexity: 386
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AA55178
ChemicalName:
Ethyl 2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazol-1-yl)propanoate
CasNumber:
1220968-24-0
MolecularFormula:
C14H23BN2O4
MolecularWeight:
294.1544
MdlNumber:
MFCD27996757
Smiles:
CCOC(=O)C(n1ncc(c1)B1OC(C(O1)(C)C)(C)C)C
Complexity:
386
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
1
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Smiles: O=C(Nc1ccc(c(c1)F)c1ccc(nc1)c1nnn(n1)C)OCc1ccccc1
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O=C(Nc1ccc(c(c1)F)c1ccc(nc1)c1nnn(n1)C)OCc1ccccc1
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Smiles: Nc1cccc(n1)B(O)O
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Nc1cccc(n1)B(O)O
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Smiles: Nc1ccc(nc1)B(O)O
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Smiles:
Nc1ccc(nc1)B(O)O
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
__
UndefinedAtomStereocenterCount:
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