AE62233
1223748-44-4 | Ethyl 5-cyclopropyl-1-methyl-1H-pyrazole-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE62233
ChemicalName
Ethyl 5-cyclopropyl-1-methyl-1H-pyrazole-3-carboxylate
CasNumber
1223748-44-4
MolecularFormula
C10H14N2O2
MolecularWeight
194.2304
MdlNumber
MFCD15072122
Smiles
CCOC(=O)c1cc(n(n1)C)C1CC1
Complexity
228
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
RotatableBondCount
4
Xlogp3
1.4
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CatalogNumber: AE62233
ChemicalName: Ethyl 5-cyclopropyl-1-methyl-1H-pyrazole-3-carboxylate
CasNumber: 1223748-44-4
MolecularFormula: C10H14N2O2
MolecularWeight: 194.2304
MdlNumber: MFCD15072122
Smiles: CCOC(=O)c1cc(n(n1)C)C1CC1
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 1.4
CatalogNumber:
AE62233
ChemicalName:
Ethyl 5-cyclopropyl-1-methyl-1H-pyrazole-3-carboxylate
CasNumber:
1223748-44-4
MolecularFormula:
C10H14N2O2
MolecularWeight:
194.2304
MdlNumber:
MFCD15072122
Smiles:
CCOC(=O)c1cc(n(n1)C)C1CC1
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
1.4
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
Xlogp3: __
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
Xlogp3:
__
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
Xlogp3: 2.2
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
Xlogp3:
2.2
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
Xlogp3: 2.2
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
Xlogp3:
2.2