AA20043
1150114-66-1 | 3-Carboxy-5-methylphenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AA20043
ChemicalName
3-Carboxy-5-methylphenylboronic acid
CasNumber
1150114-66-1
MolecularFormula
C8H9BO4
MolecularWeight
179.9657
MdlNumber
MFCD12025977
Smiles
Cc1cc(cc(c1)C(=O)O)B(O)O
Complexity
195
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
2
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CatalogNumber: AA20043
ChemicalName: 3-Carboxy-5-methylphenylboronic acid
CasNumber: 1150114-66-1
MolecularFormula: C8H9BO4
MolecularWeight: 179.9657
MdlNumber: MFCD12025977
Smiles: Cc1cc(cc(c1)C(=O)O)B(O)O
Complexity: 195
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 2
CatalogNumber:
AA20043
ChemicalName:
3-Carboxy-5-methylphenylboronic acid
CasNumber:
1150114-66-1
MolecularFormula:
C8H9BO4
MolecularWeight:
179.9657
MdlNumber:
MFCD12025977
Smiles:
Cc1cc(cc(c1)C(=O)O)B(O)O
Complexity:
195
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
2
CatalogNumber: AA20044
ChemicalName: 4,6-Dichloro-1,3-phenylenediboronic acid
CasNumber: 1150114-65-0
MolecularFormula: C6H6B2Cl2O4
MolecularWeight: 234.6374
MdlNumber: MFCD12025976
Smiles: OB(c1cc(B(O)O)c(cc1Cl)Cl)O
Complexity: 177
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 4
RotatableBondCount: 2
CatalogNumber:
AA20044
ChemicalName:
4,6-Dichloro-1,3-phenylenediboronic acid
CasNumber:
1150114-65-0
MolecularFormula:
C6H6B2Cl2O4
MolecularWeight:
234.6374
MdlNumber:
MFCD12025976
Smiles:
OB(c1cc(B(O)O)c(cc1Cl)Cl)O
Complexity:
177
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
4
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(OC(=O)c1ccc(c(c1)N)B(O)O)C.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(OC(=O)c1ccc(c(c1)N)B(O)O)C.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AA20046
ChemicalName: 2-Fluoro-6-(trifluoromethyl)pyridine-3-boronic acid
CasNumber: 1150114-63-8
MolecularFormula: C6H4BF4NO2
MolecularWeight: 208.9061
MdlNumber: MFCD12025974
Smiles: OB(c1ccc(nc1F)C(F)(F)F)O
Complexity: 201
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 1
CatalogNumber:
AA20046
ChemicalName:
2-Fluoro-6-(trifluoromethyl)pyridine-3-boronic acid
CasNumber:
1150114-63-8
MolecularFormula:
C6H4BF4NO2
MolecularWeight:
208.9061
MdlNumber:
MFCD12025974
Smiles:
OB(c1ccc(nc1F)C(F)(F)F)O
Complexity:
201
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
1