3-((4-Iodo-3,5-dimethyl-1H-pyrazol-1-yl)methyl)-4-methoxybenzoic acid

Name: 3-((4-Iodo-3,5-dimethyl-1H-pyrazol-1-yl)methyl)-4-methoxybenzoic acid
Brand: ChemScene
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CAS No. 1119471-85-0
Cat. No. CS-0365456
Molecule weight386.18
Purity≥98%
MDL No.None

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3-((4-Iodo-3,5-dimethyl-1H-pyrazol-1-yl)methyl)-4-methoxybenzoic acid|CS-0365456

Structure of 1119471-85-0

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General Information

CAS No. 1119471-85-0
Cat. No. CS-0365456
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₄H₁₅IN₂O₃
Molecular Weight 386.18
Synonym(s) 3-[(4-Iodo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxybenzoic acid
SMILES CC1=NN(CC2=C(C=CC(=C2)C(=O)O)OC)C(=C1I)C

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 64.35
LogP 2.85964
H_Acceptors 4
H_Donors 1
Rotatable_Bonds 4

Other Classifications

Building Blocks Functional Group Carboxylic Acid

Building Blocks Skeleton Aromatic heterocycle compounds Pyrazole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

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3-((4-Iodo-3,5-dimethyl-1H-pyrazol-1-yl)methyl)-4-methoxybenzoic acid

CAS No. 1119471-85-0

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