2-Chloro-N-(3-cyano-1-(4-fluorobenzyl)-4,5-dimethyl-1H-pyrrol-2-yl)acetamide

Name: 2-Chloro-N-(3-cyano-1-(4-fluorobenzyl)-4,5-dimethyl-1H-pyrrol-2-yl)acetamide
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CAS No. 852400-31-8
Cat. No. CS-0459016
Molecule weight319.77
Purity≥95%
MDL No.MFCD06655395

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Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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2-Chloro-N-(3-cyano-1-(4-fluorobenzyl)-4,5-dimethyl-1H-pyrrol-2-yl)acetamide|CS-0459016

Structure of 852400-31-8

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General Information

CAS No. 852400-31-8
Cat. No. CS-0459016
Purity ≥95%
MDL No. MFCD06655395
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₆H₁₅ClFN₃O
Molecular Weight 319.77
Synonym(s) 2-CHLORO-N-[3-CYANO-1-(4-FLUOROBENZYL)-4,5-DIMETHYL-1H-PYRROL-2-YL]ACETAMIDE
SMILES O=C(NC1=C(C#N)C(C)=C(C)N1CC2=CC=C(F)C=C2)CCl

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

TPSA 57.82
LogP 3.34132
H_Acceptors 3
H_Donors 1
Rotatable_Bonds 4

Other Classifications

Building Blocks Functional Group Fluoride

Building Blocks Functional Group Cyanide/Nitrile

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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2-Chloro-N-(3-cyano-1-(4-fluorobenzyl)-4,5-dimethyl-1H-pyrrol-2-yl)acetamide

CAS No. 852400-31-8

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