AD12526
951885-67-9 | Methyl 1-(2-nitro-4-trifluoromethylphenyl)cyclopropanecarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AD12526
ChemicalName
Methyl 1-(2-nitro-4-trifluoromethylphenyl)cyclopropanecarboxylate
CasNumber
951885-67-9
MolecularFormula
C12H10F3NO4
MolecularWeight
289.2073
MdlNumber
MFCD09878310
Smiles
COC(=O)C1(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F
Complexity
414
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
7
RotatableBondCount
3
Xlogp3
2.8
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CatalogNumber: AD12526
ChemicalName: Methyl 1-(2-nitro-4-trifluoromethylphenyl)cyclopropanecarboxylate
CasNumber: 951885-67-9
MolecularFormula: C12H10F3NO4
MolecularWeight: 289.2073
MdlNumber: MFCD09878310
Smiles: COC(=O)C1(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F
Complexity: 414
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 7
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AD12526
ChemicalName:
Methyl 1-(2-nitro-4-trifluoromethylphenyl)cyclopropanecarboxylate
CasNumber:
951885-67-9
MolecularFormula:
C12H10F3NO4
MolecularWeight:
289.2073
MdlNumber:
MFCD09878310
Smiles:
COC(=O)C1(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F
Complexity:
414
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
7
RotatableBondCount:
3
Xlogp3:
2.8
CatalogNumber: AD12527
ChemicalName: N-(4-Methoxybenzyl) 5-bromopicolinamide
CasNumber: 951885-02-2
MolecularFormula: C14H13BrN2O2
MolecularWeight: 321.1692
MdlNumber: MFCD09801060
Smiles: COc1ccc(cc1)CNC(=O)c1ccc(cn1)Br
Complexity: 293
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 2.6
CatalogNumber:
AD12527
ChemicalName:
N-(4-Methoxybenzyl) 5-bromopicolinamide
CasNumber:
951885-02-2
MolecularFormula:
C14H13BrN2O2
MolecularWeight:
321.1692
MdlNumber:
MFCD09801060
Smiles:
COc1ccc(cc1)CNC(=O)c1ccc(cn1)Br
Complexity:
293
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: Brc1cc(cc(c1)C(F)(F)F)S(=O)(=O)NC1CC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
Brc1cc(cc(c1)C(F)(F)F)S(=O)(=O)NC1CC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AD12529
ChemicalName: tert-Butyl 2-bromo-4-fluorobenzoate
CasNumber: 951884-50-7
MolecularFormula: C11H12BrFO2
MolecularWeight: 275.1142
MdlNumber: MFCD09800899
Smiles: Fc1ccc(c(c1)Br)C(=O)OC(C)(C)C
Complexity: 237
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 3.6
CatalogNumber:
AD12529
ChemicalName:
tert-Butyl 2-bromo-4-fluorobenzoate
CasNumber:
951884-50-7
MolecularFormula:
C11H12BrFO2
MolecularWeight:
275.1142
MdlNumber:
MFCD09800899
Smiles:
Fc1ccc(c(c1)Br)C(=O)OC(C)(C)C
Complexity:
237
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
3.6