AE43960
1218791-28-6 | 2-Cyano-5-nitrophenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AE43960
ChemicalName
2-Cyano-5-nitrophenylboronic acid, pinacol ester
CasNumber
1218791-28-6
MolecularFormula
C13H15BN2O4
MolecularWeight
274.0802
MdlNumber
MFCD12546472
Smiles
N#Cc1ccc(cc1B1OC(C(O1)(C)C)(C)C)[N+](=O)[O-]
Complexity
435
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
5
RotatableBondCount
1
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CatalogNumber: AE43960
ChemicalName: 2-Cyano-5-nitrophenylboronic acid, pinacol ester
CasNumber: 1218791-28-6
MolecularFormula: C13H15BN2O4
MolecularWeight: 274.0802
MdlNumber: MFCD12546472
Smiles: N#Cc1ccc(cc1B1OC(C(O1)(C)C)(C)C)[N+](=O)[O-]
Complexity: 435
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
CatalogNumber:
AE43960
ChemicalName:
2-Cyano-5-nitrophenylboronic acid, pinacol ester
CasNumber:
1218791-28-6
MolecularFormula:
C13H15BN2O4
MolecularWeight:
274.0802
MdlNumber:
MFCD12546472
Smiles:
N#Cc1ccc(cc1B1OC(C(O1)(C)C)(C)C)[N+](=O)[O-]
Complexity:
435
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
CatalogNumber: AE43961
ChemicalName: 3-Cyano-2-ethoxypyridine-5-boronic acid, pinacol ester
CasNumber: 1218791-35-5
MolecularFormula: C14H19BN2O3
MolecularWeight: 274.1233
MdlNumber: MFCD12546500
Smiles: CCOc1ncc(cc1C#N)B1OC(C(O1)(C)C)(C)C
Complexity: 389
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
CatalogNumber:
AE43961
ChemicalName:
3-Cyano-2-ethoxypyridine-5-boronic acid, pinacol ester
CasNumber:
1218791-35-5
MolecularFormula:
C14H19BN2O3
MolecularWeight:
274.1233
MdlNumber:
MFCD12546500
Smiles:
CCOc1ncc(cc1C#N)B1OC(C(O1)(C)C)(C)C
Complexity:
389
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: B(C1=CC(=C(C=C1)OC)OCC(C)C)(O)O
Complexity: 198
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
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ChemicalName:
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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:
B(C1=CC(=C(C=C1)OC)OCC(C)C)(O)O
Complexity:
198
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
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CasNumber: __
MolecularFormula: __
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Smiles: FC(S(=O)(=O)[O-])(F)F.Brc1ccc(cc1)[I+]c1ccc(cc1)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
FC(S(=O)(=O)[O-])(F)F.Brc1ccc(cc1)[I+]c1ccc(cc1)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__