AC94810
957066-03-4 | 2-Chloro-4-fluoro-5-(methoxycarbonyl)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AC94810
ChemicalName
2-Chloro-4-fluoro-5-(methoxycarbonyl)phenylboronic acid
CasNumber
957066-03-4
MolecularFormula
C8H7BClFO4
MolecularWeight
232.4011832
MdlNumber
MFCD09878351
Smiles
COC(=O)c1cc(B(O)O)c(cc1F)Cl
Complexity
241
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AC94810
ChemicalName: 2-Chloro-4-fluoro-5-(methoxycarbonyl)phenylboronic acid
CasNumber: 957066-03-4
MolecularFormula: C8H7BClFO4
MolecularWeight: 232.4011832
MdlNumber: MFCD09878351
Smiles: COC(=O)c1cc(B(O)O)c(cc1F)Cl
Complexity: 241
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AC94810
ChemicalName:
2-Chloro-4-fluoro-5-(methoxycarbonyl)phenylboronic acid
CasNumber:
957066-03-4
MolecularFormula:
C8H7BClFO4
MolecularWeight:
232.4011832
MdlNumber:
MFCD09878351
Smiles:
COC(=O)c1cc(B(O)O)c(cc1F)Cl
Complexity:
241
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: COC(=O)c1ccc(c(c1)[N+](=O)[O-])B1OC(C(O1)(C)C)(C)C
Complexity: 445
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
COC(=O)c1ccc(c(c1)[N+](=O)[O-])B1OC(C(O1)(C)C)(C)C
Complexity:
445
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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MolecularFormula: __
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Smiles: CCc1nnc(o1)c1cccc(c1)Br
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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CatalogNumber:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CCc1nnc(o1)c1cccc(c1)Br
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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ChemicalName: __
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MolecularFormula: __
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Smiles: OB(c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)OC(F)(F)F)O
Complexity: 495
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OB(c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)OC(F)(F)F)O
Complexity:
495
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__