AE62234
1256360-49-2 | 2-Bromo-6-trifluoromethylpyridine-4-boronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AE62234
ChemicalName
2-Bromo-6-trifluoromethylpyridine-4-boronic acid, pinacol ester
CasNumber
1256360-49-2
MolecularFormula
C12H14BBrF3NO2
MolecularWeight
351.9553
MdlNumber
MFCD17926520
Smiles
Brc1cc(cc(n1)C(F)(F)F)B1OC(C(O1)(C)C)(C)C
Complexity
362
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
6
RotatableBondCount
1
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CatalogNumber: AE62234
ChemicalName: 2-Bromo-6-trifluoromethylpyridine-4-boronic acid, pinacol ester
CasNumber: 1256360-49-2
MolecularFormula: C12H14BBrF3NO2
MolecularWeight: 351.9553
MdlNumber: MFCD17926520
Smiles: Brc1cc(cc(n1)C(F)(F)F)B1OC(C(O1)(C)C)(C)C
Complexity: 362
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 6
RotatableBondCount: 1
CatalogNumber:
AE62234
ChemicalName:
2-Bromo-6-trifluoromethylpyridine-4-boronic acid, pinacol ester
CasNumber:
1256360-49-2
MolecularFormula:
C12H14BBrF3NO2
MolecularWeight:
351.9553
MdlNumber:
MFCD17926520
Smiles:
Brc1cc(cc(n1)C(F)(F)F)B1OC(C(O1)(C)C)(C)C
Complexity:
362
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
6
RotatableBondCount:
1
CatalogNumber: AE62235
ChemicalName: Ethyl 4-methanesulfonylcinnamate
CasNumber: 137473-27-9
MolecularFormula: C12H14O4S
MolecularWeight: 254.3022
MdlNumber: MFCD22124828
Smiles: CCOC(=O)/C=C/c1ccc(cc1)S(=O)(=O)C
Complexity: 370
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
CatalogNumber:
AE62235
ChemicalName:
Ethyl 4-methanesulfonylcinnamate
CasNumber:
137473-27-9
MolecularFormula:
C12H14O4S
MolecularWeight:
254.3022
MdlNumber:
MFCD22124828
Smiles:
CCOC(=O)/C=C/c1ccc(cc1)S(=O)(=O)C
Complexity:
370
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
CatalogNumber: AE62236
ChemicalName: Ethyl 1-isopropyl-1,2,3-benzotriazole-5-carboxylate
CasNumber: 1352217-61-8
MolecularFormula: C12H15N3O2
MolecularWeight: 233.2664
MdlNumber: MFCD20920217
Smiles: CCOC(=O)c1ccc2c(c1)nnn2C(C)C
Complexity: 283
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
CatalogNumber:
AE62236
ChemicalName:
Ethyl 1-isopropyl-1,2,3-benzotriazole-5-carboxylate
CasNumber:
1352217-61-8
MolecularFormula:
C12H15N3O2
MolecularWeight:
233.2664
MdlNumber:
MFCD20920217
Smiles:
CCOC(=O)c1ccc2c(c1)nnn2C(C)C
Complexity:
283
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
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Smiles: CCOC(=O)c1ccc2c(c1)nnn2CC
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Smiles:
CCOC(=O)c1ccc2c(c1)nnn2CC
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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