AI03459
957062-53-2 | 5-(Ethoxycarbonyl)-2-methoxyphenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AI03459
ChemicalName
5-(Ethoxycarbonyl)-2-methoxyphenylboronic acid
CasNumber
957062-53-2
MolecularFormula
C10H13BO5
MolecularWeight
224.0182
MdlNumber
MFCD09800892
Smiles
CCOC(=O)c1ccc(c(c1)B(O)O)OC
Complexity
233
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
5
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CatalogNumber: AI03459
ChemicalName: 5-(Ethoxycarbonyl)-2-methoxyphenylboronic acid
CasNumber: 957062-53-2
MolecularFormula: C10H13BO5
MolecularWeight: 224.0182
MdlNumber: MFCD09800892
Smiles: CCOC(=O)c1ccc(c(c1)B(O)O)OC
Complexity: 233
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 5
CatalogNumber:
AI03459
ChemicalName:
5-(Ethoxycarbonyl)-2-methoxyphenylboronic acid
CasNumber:
957062-53-2
MolecularFormula:
C10H13BO5
MolecularWeight:
224.0182
MdlNumber:
MFCD09800892
Smiles:
CCOC(=O)c1ccc(c(c1)B(O)O)OC
Complexity:
233
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COCCCNC(=O)c1cccc(c1)B(O)O
Complexity: 238
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COCCCNC(=O)c1cccc(c1)B(O)O
Complexity:
238
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AI03461
ChemicalName: 2,3-Difluoro-6-methoxyphenylboronic acid
CasNumber: 957061-21-1
MolecularFormula: C7H7BF2O3
MolecularWeight: 187.9365
MdlNumber: MFCD03095116
Smiles: COc1ccc(c(c1B(O)O)F)F
Complexity: 170
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AI03461
ChemicalName:
2,3-Difluoro-6-methoxyphenylboronic acid
CasNumber:
957061-21-1
MolecularFormula:
C7H7BF2O3
MolecularWeight:
187.9365
MdlNumber:
MFCD03095116
Smiles:
COc1ccc(c(c1B(O)O)F)F
Complexity:
170
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: AI03462
ChemicalName: 4-(3-Bromopropoxy)phenylboronic acid, pinacol ester
CasNumber: 957061-13-1
MolecularFormula: C15H22BBrO3
MolecularWeight: 341.0484
MdlNumber: MFCD09258657
Smiles: BrCCCOc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 298
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 5
CatalogNumber:
AI03462
ChemicalName:
4-(3-Bromopropoxy)phenylboronic acid, pinacol ester
CasNumber:
957061-13-1
MolecularFormula:
C15H22BBrO3
MolecularWeight:
341.0484
MdlNumber:
MFCD09258657
Smiles:
BrCCCOc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
298
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
5