AE45328
1426958-36-2 | 1-Butyl-3-(trifluoromethyl)pyrazole
Manufacturer: A2B Chem
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CatalogNumber
AE45328
ChemicalName
1-Butyl-3-(trifluoromethyl)pyrazole
CasNumber
1426958-36-2
MolecularFormula
C8H11F3N2
MolecularWeight
192.1815
MdlNumber
MFCD21668277
Smiles
CCCCn1ccc(n1)C(F)(F)F
Complexity
158
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
2.3
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CatalogNumber: AE45328
ChemicalName: 1-Butyl-3-(trifluoromethyl)pyrazole
CasNumber: 1426958-36-2
MolecularFormula: C8H11F3N2
MolecularWeight: 192.1815
MdlNumber: MFCD21668277
Smiles: CCCCn1ccc(n1)C(F)(F)F
Complexity: 158
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 2.3
CatalogNumber:
AE45328
ChemicalName:
1-Butyl-3-(trifluoromethyl)pyrazole
CasNumber:
1426958-36-2
MolecularFormula:
C8H11F3N2
MolecularWeight:
192.1815
MdlNumber:
MFCD21668277
Smiles:
CCCCn1ccc(n1)C(F)(F)F
Complexity:
158
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
2.3
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Smiles: N#CCCOP(N(C(C)C)C(C)C)O[C@@H]1[C@H](O[Si](C(C)(C)C)(C)C)[C@H](O[C@H]1n1ccc(=O)[nH]c1=O)COC(c1ccc(cc1)OC)(c1ccc(cc1)OC)c1ccccc1
Complexity: __
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Smiles:
N#CCCOP(N(C(C)C)C(C)C)O[C@@H]1[C@H](O[Si](C(C)(C)C)(C)C)[C@H](O[C@H]1n1ccc(=O)[nH]c1=O)COC(c1ccc(cc1)OC)(c1ccc(cc1)OC)c1ccccc1
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RotatableBondCount:
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Smiles: CCNCc1nccnc1Cl
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CCNCc1nccnc1Cl
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MolecularFormula:
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MdlNumber:
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Smiles:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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