AA54515
1218790-17-0 | 2-Fluoro-5-(methoxycarbonyl)-4-methylphenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AA54515
ChemicalName
2-Fluoro-5-(methoxycarbonyl)-4-methylphenylboronic acid, pinacol ester
CasNumber
1218790-17-0
MolecularFormula
C15H20BFO4
MolecularWeight
294.1263
MdlNumber
MFCD13195766
Smiles
COC(=O)c1cc(B2OC(C(O2)(C)C)(C)C)c(cc1C)F
Complexity
397
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
5
RotatableBondCount
3
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CatalogNumber: AA54515
ChemicalName: 2-Fluoro-5-(methoxycarbonyl)-4-methylphenylboronic acid, pinacol ester
CasNumber: 1218790-17-0
MolecularFormula: C15H20BFO4
MolecularWeight: 294.1263
MdlNumber: MFCD13195766
Smiles: COC(=O)c1cc(B2OC(C(O2)(C)C)(C)C)c(cc1C)F
Complexity: 397
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
CatalogNumber:
AA54515
ChemicalName:
2-Fluoro-5-(methoxycarbonyl)-4-methylphenylboronic acid, pinacol ester
CasNumber:
1218790-17-0
MolecularFormula:
C15H20BFO4
MolecularWeight:
294.1263
MdlNumber:
MFCD13195766
Smiles:
COC(=O)c1cc(B2OC(C(O2)(C)C)(C)C)c(cc1C)F
Complexity:
397
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
CatalogNumber: AA54516
ChemicalName: 3-Chloro-5-cyano-2-fluorophenylboronic acid, pinacol ester
CasNumber: 1218790-15-8
MolecularFormula: C13H14BClFNO2
MolecularWeight: 281.5182
MdlNumber: MFCD15143597
Smiles: N#Cc1cc(B2OC(C(O2)(C)C)(C)C)c(c(c1)Cl)F
Complexity: 393
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
CatalogNumber:
AA54516
ChemicalName:
3-Chloro-5-cyano-2-fluorophenylboronic acid, pinacol ester
CasNumber:
1218790-15-8
MolecularFormula:
C13H14BClFNO2
MolecularWeight:
281.5182
MdlNumber:
MFCD15143597
Smiles:
N#Cc1cc(B2OC(C(O2)(C)C)(C)C)c(c(c1)Cl)F
Complexity:
393
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
CatalogNumber: AA54517
ChemicalName: 4-Chloro-5-cyano-2-fluorophenylboronic acid, pinacol ester
CasNumber: 1218790-13-6
MolecularFormula: C13H14BClFNO2
MolecularWeight: 281.5182
MdlNumber: MFCD13195765
Smiles: N#Cc1cc(B2OC(C(O2)(C)C)(C)C)c(cc1Cl)F
Complexity: 393
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
CatalogNumber:
AA54517
ChemicalName:
4-Chloro-5-cyano-2-fluorophenylboronic acid, pinacol ester
CasNumber:
1218790-13-6
MolecularFormula:
C13H14BClFNO2
MolecularWeight:
281.5182
MdlNumber:
MFCD13195765
Smiles:
N#Cc1cc(B2OC(C(O2)(C)C)(C)C)c(cc1Cl)F
Complexity:
393
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(Nc1cncc(c1)B1OC(C(O1)(C)C)(C)C)OCc1ccccc1
Complexity: 478
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(Nc1cncc(c1)B1OC(C(O1)(C)C)(C)C)OCc1ccccc1
Complexity:
478
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__