4-(3-Methylbutanoyl)-N-(3-(trifluoromethyl)benzyl)-1H-pyrrole-2-carboxamide

Name: 4-(3-Methylbutanoyl)-N-(3-(trifluoromethyl)benzyl)-1H-pyrrole-2-carboxamide
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CAS No. 439111-94-1
Cat. No. CS-0545602
Purity≥98%
MDL No.None

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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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4-(3-Methylbutanoyl)-N-(3-(trifluoromethyl)benzyl)-1H-pyrrole-2-carboxamide|CS-0545602

Structure of 439111-94-1

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General Information

CAS No. 439111-94-1
Cat. No. CS-0545602
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₈H₁₉F₃N₂O₂
Molecular Weight 352.35
Synonym(s) 4-(3-METHYLBUTANOYL)-N-[3-(TRIFLUOROMETHYL)BENZYL]-1H-PYRROLE-2-CARBOXAMIDE
SMILES O=C(C1=CC(C(CC(C)C)=O)=CN1)NCC2=CC=CC(C(F)(F)F)=C2

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 61.96
LogP 4.1923
H_Acceptors 2
H_Donors 2
Rotatable_Bonds 6

Other Classifications

Building Blocks Functional Group Ketone

Building Blocks Functional Group Amide

Building Blocks Skeleton Aromatic heterocycle compounds Pyrrole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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4-(3-Methylbutanoyl)-N-(3-(trifluoromethyl)benzyl)-1H-pyrrole-2-carboxamide

CAS No. 439111-94-1

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