AI30857
1341766-01-5 | 1-Isopropyl-4-(trifluoromethyl)-1h-pyrrole-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AI30857
ChemicalName
1-Isopropyl-4-(trifluoromethyl)-1h-pyrrole-3-carboxylic acid
CasNumber
1341766-01-5
MolecularFormula
C9H10F3NO2
MolecularWeight
221.1764
MdlNumber
MFCD19611410
Smiles
CC(n1cc(c(c1)C(F)(F)F)C(=O)O)C
Complexity
252
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.8
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CatalogNumber: AI30857
ChemicalName: 1-Isopropyl-4-(trifluoromethyl)-1h-pyrrole-3-carboxylic acid
CasNumber: 1341766-01-5
MolecularFormula: C9H10F3NO2
MolecularWeight: 221.1764
MdlNumber: MFCD19611410
Smiles: CC(n1cc(c(c1)C(F)(F)F)C(=O)O)C
Complexity: 252
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AI30857
ChemicalName:
1-Isopropyl-4-(trifluoromethyl)-1h-pyrrole-3-carboxylic acid
CasNumber:
1341766-01-5
MolecularFormula:
C9H10F3NO2
MolecularWeight:
221.1764
MdlNumber:
MFCD19611410
Smiles:
CC(n1cc(c(c1)C(F)(F)F)C(=O)O)C
Complexity:
252
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: O=C1CCCC21CCCO2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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MolecularFormula:
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Smiles:
O=C1CCCC21CCCO2
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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Smiles: OCCOCCOCCOCCO[Si](C(C)(C)C)(C)C
Complexity: 228
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
OCCOCCOCCOCCO[Si](C(C)(C)C)(C)C
Complexity:
228
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CS(=O)(=O)OCCOCCOCCOCCO[Si](C(C)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CS(=O)(=O)OCCOCCOCCOCCO[Si](C(C)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__