AA54499
1218789-53-7 | 3-Bromo-5-(ethoxycarbonylmethoxy)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AA54499
ChemicalName
3-Bromo-5-(ethoxycarbonylmethoxy)phenylboronic acid, pinacol ester
CasNumber
1218789-53-7
MolecularFormula
C16H22BBrO5
MolecularWeight
385.0579
MdlNumber
MFCD12546592
Smiles
CCOC(=O)COc1cc(Br)cc(c1)B1OC(C(O1)(C)C)(C)C
Complexity
413
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
5
RotatableBondCount
6
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CatalogNumber: AA54499
ChemicalName: 3-Bromo-5-(ethoxycarbonylmethoxy)phenylboronic acid, pinacol ester
CasNumber: 1218789-53-7
MolecularFormula: C16H22BBrO5
MolecularWeight: 385.0579
MdlNumber: MFCD12546592
Smiles: CCOC(=O)COc1cc(Br)cc(c1)B1OC(C(O1)(C)C)(C)C
Complexity: 413
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 5
RotatableBondCount: 6
CatalogNumber:
AA54499
ChemicalName:
3-Bromo-5-(ethoxycarbonylmethoxy)phenylboronic acid, pinacol ester
CasNumber:
1218789-53-7
MolecularFormula:
C16H22BBrO5
MolecularWeight:
385.0579
MdlNumber:
MFCD12546592
Smiles:
CCOC(=O)COc1cc(Br)cc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
413
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
5
RotatableBondCount:
6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1cc(cc(c1)B1OC(C(O1)(C)C)(C)C)O[Si](C(C)(C)C)(C)C
Complexity: 446
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1cc(cc(c1)B1OC(C(O1)(C)C)(C)C)O[Si](C(C)(C)C)(C)C
Complexity:
446
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: AA54501
ChemicalName: 3-Bromo-5-hydroxyphenylboronic acid
CasNumber: 1218789-50-4
MolecularFormula: C12H16BBrO3
MolecularWeight: 298.9686
MdlNumber: MFCD12546589
Smiles: Oc1cc(Br)cc(c1)B1OC(C(O1)(C)C)(C)C
Complexity: 280
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
CatalogNumber:
AA54501
ChemicalName:
3-Bromo-5-hydroxyphenylboronic acid
CasNumber:
1218789-50-4
MolecularFormula:
C12H16BBrO3
MolecularWeight:
298.9686
MdlNumber:
MFCD12546589
Smiles:
Oc1cc(Br)cc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
280
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1cc(OCC2CC2)cc(c1)B1OC(C(O1)(C)C)(C)C
Complexity: 368
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1cc(OCC2CC2)cc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
368
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__