AH96279
862081-37-6 | 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isobenzofuran-1(3H)-one
Manufacturer: A2B Chem
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CatalogNumber
AH96279
ChemicalName
5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isobenzofuran-1(3H)-one
CasNumber
862081-37-6
MolecularFormula
C14H17BO4
MolecularWeight
260.09338
MdlNumber
MFCD18251723
Smiles
O=C1OCc2c1ccc(c2)B1OC(C(O1)(C)C)(C)C
Complexity
377
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
RotatableBondCount
1
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CatalogNumber: AH96279
ChemicalName: 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isobenzofuran-1(3H)-one
CasNumber: 862081-37-6
MolecularFormula: C14H17BO4
MolecularWeight: 260.09338
MdlNumber: MFCD18251723
Smiles: O=C1OCc2c1ccc(c2)B1OC(C(O1)(C)C)(C)C
Complexity: 377
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
CatalogNumber:
AH96279
ChemicalName:
5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isobenzofuran-1(3H)-one
CasNumber:
862081-37-6
MolecularFormula:
C14H17BO4
MolecularWeight:
260.09338
MdlNumber:
MFCD18251723
Smiles:
O=C1OCc2c1ccc(c2)B1OC(C(O1)(C)C)(C)C
Complexity:
377
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
CatalogNumber: AH96280
ChemicalName: 5-(Difluoromethyl)pyridine-2-carboxylic acid
CasNumber: 859538-41-3
MolecularFormula: C7H5F2NO2
MolecularWeight: 173.11690639999998
MdlNumber: MFCD18256209
Smiles: FC(c1ccc(nc1)C(=O)O)F
Complexity: 175
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
CatalogNumber:
AH96280
ChemicalName:
5-(Difluoromethyl)pyridine-2-carboxylic acid
CasNumber:
859538-41-3
MolecularFormula:
C7H5F2NO2
MolecularWeight:
173.11690639999998
MdlNumber:
MFCD18256209
Smiles:
FC(c1ccc(nc1)C(=O)O)F
Complexity:
175
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
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Smiles: [O-]C(=O)c1cc(nc2n1ncc2)C(=O)OC
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[O-]C(=O)c1cc(nc2n1ncc2)C(=O)OC
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Smiles: OC(=O)c1cc(cc2c1[nH]cc2)C(F)(F)F
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Smiles:
OC(=O)c1cc(cc2c1[nH]cc2)C(F)(F)F
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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