AA20282
1150561-67-3 | 3-Carboxy-5-methylphenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AA20282
ChemicalName
3-Carboxy-5-methylphenylboronic acid, pinacol ester
CasNumber
1150561-67-3
MolecularFormula
C14H19BO4
MolecularWeight
262.1093
MdlNumber
MFCD12026101
Smiles
Cc1cc(cc(c1)C(=O)O)B1OC(C(O1)(C)C)(C)C
Complexity
351
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
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CatalogNumber: AA20282
ChemicalName: 3-Carboxy-5-methylphenylboronic acid, pinacol ester
CasNumber: 1150561-67-3
MolecularFormula: C14H19BO4
MolecularWeight: 262.1093
MdlNumber: MFCD12026101
Smiles: Cc1cc(cc(c1)C(=O)O)B1OC(C(O1)(C)C)(C)C
Complexity: 351
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AA20282
ChemicalName:
3-Carboxy-5-methylphenylboronic acid, pinacol ester
CasNumber:
1150561-67-3
MolecularFormula:
C14H19BO4
MolecularWeight:
262.1093
MdlNumber:
MFCD12026101
Smiles:
Cc1cc(cc(c1)C(=O)O)B1OC(C(O1)(C)C)(C)C
Complexity:
351
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
CatalogNumber: AA20284
ChemicalName: 2-Fluoro-5-pentanoyl-1,3-phenylenediboronic acid, pinacol ester
CasNumber: 1150561-65-1
MolecularFormula: C23H35B2FO5
MolecularWeight: 432.1414
MdlNumber: MFCD12026098
Smiles: CCCCC(=O)c1cc(B2OC(C(O2)(C)C)(C)C)c(c(c1)B1OC(C(O1)(C)C)(C)C)F
Complexity: 603
Covalently-bondedUnitCount: 1
HeavyAtomCount: 31
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: __
RotatableBondCount: 6
CatalogNumber:
AA20284
ChemicalName:
2-Fluoro-5-pentanoyl-1,3-phenylenediboronic acid, pinacol ester
CasNumber:
1150561-65-1
MolecularFormula:
C23H35B2FO5
MolecularWeight:
432.1414
MdlNumber:
MFCD12026098
Smiles:
CCCCC(=O)c1cc(B2OC(C(O2)(C)C)(C)C)c(c(c1)B1OC(C(O1)(C)C)(C)C)F
Complexity:
603
Covalently-bondedUnitCount:
1
HeavyAtomCount:
31
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
__
RotatableBondCount:
6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)Nc1ccc(cn1)B1OC(C(O1)(C)C)(C)C.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)Nc1ccc(cn1)B1OC(C(O1)(C)C)(C)C.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AA20286
ChemicalName: 3-Methoxycarbonyl-5-trifluoromethoxylphenylboronic acid, pinacol ester
CasNumber: 1150561-63-9
MolecularFormula: C15H18BF3O5
MolecularWeight: 346.1066
MdlNumber: MFCD12026096
Smiles: COC(=O)c1cc(cc(c1)B1OC(C(O1)(C)C)(C)C)OC(F)(F)F
Complexity: 464
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: __
RotatableBondCount: 4
CatalogNumber:
AA20286
ChemicalName:
3-Methoxycarbonyl-5-trifluoromethoxylphenylboronic acid, pinacol ester
CasNumber:
1150561-63-9
MolecularFormula:
C15H18BF3O5
MolecularWeight:
346.1066
MdlNumber:
MFCD12026096
Smiles:
COC(=O)c1cc(cc(c1)B1OC(C(O1)(C)C)(C)C)OC(F)(F)F
Complexity:
464
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
__
RotatableBondCount:
4