AC94809
957066-06-7 | 5-Borono-4-chloro-2-fluorobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AC94809
ChemicalName
5-Borono-4-chloro-2-fluorobenzoic acid
CasNumber
957066-06-7
MolecularFormula
C7H5BClFO4
MolecularWeight
218.3746
MdlNumber
MFCD09878325
Smiles
OB(c1cc(C(=O)O)c(cc1Cl)F)O
Complexity
228
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
3
RotatableBondCount
2
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CatalogNumber: AC94809
ChemicalName: 5-Borono-4-chloro-2-fluorobenzoic acid
CasNumber: 957066-06-7
MolecularFormula: C7H5BClFO4
MolecularWeight: 218.3746
MdlNumber: MFCD09878325
Smiles: OB(c1cc(C(=O)O)c(cc1Cl)F)O
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 3
RotatableBondCount: 2
CatalogNumber:
AC94809
ChemicalName:
5-Borono-4-chloro-2-fluorobenzoic acid
CasNumber:
957066-06-7
MolecularFormula:
C7H5BClFO4
MolecularWeight:
218.3746
MdlNumber:
MFCD09878325
Smiles:
OB(c1cc(C(=O)O)c(cc1Cl)F)O
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
3
RotatableBondCount:
2
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: __
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Smiles: COC(=O)c1ccc(c(c1)[N+](=O)[O-])B1OC(C(O1)(C)C)(C)C
Complexity: 445
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Smiles:
COC(=O)c1ccc(c(c1)[N+](=O)[O-])B1OC(C(O1)(C)C)(C)C
Complexity:
445
Covalently-bondedUnitCount:
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Smiles: CCc1nnc(o1)c1cccc(c1)Br
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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:
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HydrogenBondDonorCount:
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RotatableBondCount:
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