AH58742
849934-85-6 | 6-Ethoxy-5-(trifluoromethyl)-3-pyridinyl boronic acid
Manufacturer: A2B Chem
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CatalogNumber
AH58742
ChemicalName
6-Ethoxy-5-(trifluoromethyl)-3-pyridinyl boronic acid
CasNumber
849934-85-6
MolecularFormula
C8H9BF3NO3
MolecularWeight
234.9682
MdlNumber
MFCD13195241
Smiles
CCOc1ncc(cc1C(F)(F)F)B(O)O
Complexity
227
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AH58742
ChemicalName: 6-Ethoxy-5-(trifluoromethyl)-3-pyridinyl boronic acid
CasNumber: 849934-85-6
MolecularFormula: C8H9BF3NO3
MolecularWeight: 234.9682
MdlNumber: MFCD13195241
Smiles: CCOc1ncc(cc1C(F)(F)F)B(O)O
Complexity: 227
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AH58742
ChemicalName:
6-Ethoxy-5-(trifluoromethyl)-3-pyridinyl boronic acid
CasNumber:
849934-85-6
MolecularFormula:
C8H9BF3NO3
MolecularWeight:
234.9682
MdlNumber:
MFCD13195241
Smiles:
CCOc1ncc(cc1C(F)(F)F)B(O)O
Complexity:
227
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: AH58743
ChemicalName: 4-Bromo-2-methoxybenzamide
CasNumber: 812667-44-0
MolecularFormula: C8H8BrNO2
MolecularWeight: 230.05862
MdlNumber: MFCD12913570
Smiles: COc1cc(Br)ccc1C(=O)N
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AH58743
ChemicalName:
4-Bromo-2-methoxybenzamide
CasNumber:
812667-44-0
MolecularFormula:
C8H8BrNO2
MolecularWeight:
230.05862
MdlNumber:
MFCD12913570
Smiles:
COc1cc(Br)ccc1C(=O)N
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
CatalogNumber: AH58744
ChemicalName: N-Cyclohexyl 4-bromo-3-nitrobenzamide
CasNumber: 849537-85-5
MolecularFormula: C13H15BrN2O3
MolecularWeight: 327.1738
MdlNumber: MFCD07356031
Smiles: O=C(c1ccc(c(c1)[N+](=O)[O-])Br)NC1CCCCC1
Complexity: 339
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AH58744
ChemicalName:
N-Cyclohexyl 4-bromo-3-nitrobenzamide
CasNumber:
849537-85-5
MolecularFormula:
C13H15BrN2O3
MolecularWeight:
327.1738
MdlNumber:
MFCD07356031
Smiles:
O=C(c1ccc(c(c1)[N+](=O)[O-])Br)NC1CCCCC1
Complexity:
339
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
CatalogNumber: AH58745
ChemicalName: 5-Bromo-2-hydroxybenzaldehyde Oxime
CasNumber: 82486-43-9
MolecularFormula: C7H6BrNO2
MolecularWeight: 216.032
MdlNumber: MFCD00187114
Smiles: Oc1ccc(cc1/C=N/O)Br
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
CatalogNumber:
AH58745
ChemicalName:
5-Bromo-2-hydroxybenzaldehyde Oxime
CasNumber:
82486-43-9
MolecularFormula:
C7H6BrNO2
MolecularWeight:
216.032
MdlNumber:
MFCD00187114
Smiles:
Oc1ccc(cc1/C=N/O)Br
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1