AA50449
1373168-89-8 | 3-Carboxy-2-fluorophenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AA50449
ChemicalName
3-Carboxy-2-fluorophenylboronic acid, pinacol ester
CasNumber
1373168-89-8
MolecularFormula
C13H16BFO4
MolecularWeight
266.0731
MdlNumber
MFCD19237225
Smiles
OC(=O)c1cccc(c1F)B1OC(C(O1)(C)C)(C)C
Complexity
356
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
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CatalogNumber: AA50449
ChemicalName: 3-Carboxy-2-fluorophenylboronic acid, pinacol ester
CasNumber: 1373168-89-8
MolecularFormula: C13H16BFO4
MolecularWeight: 266.0731
MdlNumber: MFCD19237225
Smiles: OC(=O)c1cccc(c1F)B1OC(C(O1)(C)C)(C)C
Complexity: 356
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AA50449
ChemicalName:
3-Carboxy-2-fluorophenylboronic acid, pinacol ester
CasNumber:
1373168-89-8
MolecularFormula:
C13H16BFO4
MolecularWeight:
266.0731
MdlNumber:
MFCD19237225
Smiles:
OC(=O)c1cccc(c1F)B1OC(C(O1)(C)C)(C)C
Complexity:
356
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: Clc1ccc(cc1)C(=O)Cc1ccc(c(c1)F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
Clc1ccc(cc1)C(=O)Cc1ccc(c(c1)F)F
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: O=Cc1cccc2c1n(C)cc2C#N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
O=Cc1cccc2c1n(C)cc2C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1cccc2c1[nH]cc2C#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1cccc2c1[nH]cc2C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__