AD25951
454185-98-9 | (4-Methoxycarbonylmethyl)phenylboronic acid pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AD25951
ChemicalName
(4-Methoxycarbonylmethyl)phenylboronic acid pinacol ester
CasNumber
454185-98-9
MolecularFormula
C15H21BO4
MolecularWeight
276.13584
MdlNumber
MFCD09997797
Smiles
COC(=O)Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity
343
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
RotatableBondCount
4
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CatalogNumber: AD25951
ChemicalName: (4-Methoxycarbonylmethyl)phenylboronic acid pinacol ester
CasNumber: 454185-98-9
MolecularFormula: C15H21BO4
MolecularWeight: 276.13584
MdlNumber: MFCD09997797
Smiles: COC(=O)Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 343
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
CatalogNumber:
AD25951
ChemicalName:
(4-Methoxycarbonylmethyl)phenylboronic acid pinacol ester
CasNumber:
454185-98-9
MolecularFormula:
C15H21BO4
MolecularWeight:
276.13584
MdlNumber:
MFCD09997797
Smiles:
COC(=O)Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
343
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
CatalogNumber: __
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Smiles: O=C=NCCCCCCCCCCN=C=O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
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Smiles:
O=C=NCCCCCCCCCCN=C=O
Complexity:
__
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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ChemicalName: __
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Smiles: CSCC1CO1
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Smiles:
CSCC1CO1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: CC(C(=O)O)CCCC
Complexity: 88.9
Covalently-bondedUnitCount: __
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HydrogenBondAcceptorCount: __
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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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MdlNumber:
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Smiles:
CC(C(=O)O)CCCC
Complexity:
88.9
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__