AD45562
1072945-04-0 | 4-Chloromethylphenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AD45562
ChemicalName
4-Chloromethylphenylboronic acid, pinacol ester
CasNumber
1072945-04-0
MolecularFormula
C13H18BClO2
MolecularWeight
252.5448
MdlNumber
MFCD11053893
Smiles
ClCc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity
257
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
2
RotatableBondCount
2
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CatalogNumber: AD45562
ChemicalName: 4-Chloromethylphenylboronic acid, pinacol ester
CasNumber: 1072945-04-0
MolecularFormula: C13H18BClO2
MolecularWeight: 252.5448
MdlNumber: MFCD11053893
Smiles: ClCc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 257
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
CatalogNumber:
AD45562
ChemicalName:
4-Chloromethylphenylboronic acid, pinacol ester
CasNumber:
1072945-04-0
MolecularFormula:
C13H18BClO2
MolecularWeight:
252.5448
MdlNumber:
MFCD11053893
Smiles:
ClCc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
257
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(n1cccc1B1OC(C(O1)(C)C)(C)C)OC(C)(C)C
Complexity: 400
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
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MolecularFormula:
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Smiles:
O=C(n1cccc1B1OC(C(O1)(C)C)(C)C)OC(C)(C)C
Complexity:
400
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Smiles: OC(=O)c1ccc(cc1)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
Complexity: __
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Smiles:
OC(=O)c1ccc(cc1)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: c1ccc(cc1)c1cc2c([nH]1)nccc2
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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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Smiles:
c1ccc(cc1)c1cc2c([nH]1)nccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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