AA09898
1025718-91-5 | 3-(Methoxycarbonyl)pyridine-5-boronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AA09898
ChemicalName
3-(Methoxycarbonyl)pyridine-5-boronic acid, pinacol ester
CasNumber
1025718-91-5
MolecularFormula
C13H18BNO4
MolecularWeight
263.0973
MdlNumber
MFCD09027079
Smiles
COC(=O)c1cncc(c1)B1OC(C(O1)(C)C)(C)C
Complexity
343
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
5
RotatableBondCount
3
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CatalogNumber: AA09898
ChemicalName: 3-(Methoxycarbonyl)pyridine-5-boronic acid, pinacol ester
CasNumber: 1025718-91-5
MolecularFormula: C13H18BNO4
MolecularWeight: 263.0973
MdlNumber: MFCD09027079
Smiles: COC(=O)c1cncc(c1)B1OC(C(O1)(C)C)(C)C
Complexity: 343
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
CatalogNumber:
AA09898
ChemicalName:
3-(Methoxycarbonyl)pyridine-5-boronic acid, pinacol ester
CasNumber:
1025718-91-5
MolecularFormula:
C13H18BNO4
MolecularWeight:
263.0973
MdlNumber:
MFCD09027079
Smiles:
COC(=O)c1cncc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
343
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc(cc(n1)B1OC(C(O1)(C)C)(C)C)B1OC(C(O1)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc(cc(n1)B1OC(C(O1)(C)C)(C)C)B1OC(C(O1)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1ccc(c(c1)O)Cl)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(c1ccc(c(c1)O)Cl)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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CatalogNumber: AA09901
ChemicalName: 3-Bromo-5-(trifluoromethyl)phenol
CasNumber: 1025718-84-6
MolecularFormula: C7H4BrF3O
MolecularWeight: 241.00526959999993
MdlNumber: MFCD11041083
Smiles: Oc1cc(Br)cc(c1)C(F)(F)F
Complexity: 159
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
RotatableBondCount: __
CatalogNumber:
AA09901
ChemicalName:
3-Bromo-5-(trifluoromethyl)phenol
CasNumber:
1025718-84-6
MolecularFormula:
C7H4BrF3O
MolecularWeight:
241.00526959999993
MdlNumber:
MFCD11041083
Smiles:
Oc1cc(Br)cc(c1)C(F)(F)F
Complexity:
159
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
RotatableBondCount:
__