α-[[4-(Dimethylamino)phenyl]methylene]-2-benzothiazoleacetonitrile

Name: α-[[4-(Dimethylamino)phenyl]methylene]-2-benzothiazoleacetonitrile
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CAS No. 112632-96-9
Cat. No. CS-0440965
Molecule weight305.41
Purity≥98%
MDL No.MFCD00638448

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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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α-[[4-(Dimethylamino)phenyl]methylene]-2-benzothiazoleacetonitrile|CS-0440965

Structure of 112632-96-9

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General Information

CAS No. 112632-96-9
Cat. No. CS-0440965
Purity ≥98%
MDL No. MFCD00638448
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₈H₁₅N₃S
Molecular Weight 305.41
Synonym(s) 2-Benzothiazol-2-yl-3-(4-dimethylamino-phenyl)-acrylonitrile
SMILES CN(C)C1=CC=C(C=C1)/C=C(\C#N)/C2=NC3=CC=CC=C3S2

Safety Information

Download SDS

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 39.92
LogP 4.42648
H_Acceptors 4
H_Donors 0
Rotatable_Bonds 3

Other Classifications

Building Blocks Functional Group Cyanide/Nitrile

Building Blocks Functional Group Olefins

Building Blocks Skeleton Aromatic heterocycle compounds Benzothiazole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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α-[[4-(Dimethylamino)phenyl]methylene]-2-benzothiazoleacetonitrile

CAS No. 112632-96-9

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