3-(6-Chloro-3-oxo-2,3-dihydro-4H-benzo[b][1,4]oxazin-4-yl)propanenitrile

Name: 3-(6-Chloro-3-oxo-2,3-dihydro-4H-benzo[b][1,4]oxazin-4-yl)propanenitrile
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CAS No. 351003-20-8
Cat. No. CS-0332675
Molecule weight236.65
Purity≥98%
MDL No.None

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3-(6-Chloro-3-oxo-2,3-dihydro-4H-benzo[b][1,4]oxazin-4-yl)propanenitrile|CS-0332675

Structure of 351003-20-8

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General Information

CAS No. 351003-20-8
Cat. No. CS-0332675
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₉ClN₂O₂
Molecular Weight 236.65
Synonym(s) 3-(6-Chloro-3-oxo-1,4-benzoxazin-4-yl)propanenitrile
SMILES C(C#N)CN1C2=CC(=CC=C2OCC1=O)Cl

Safety Information

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GHS Pictogram :	GHS No : GHS06
Signal Word : Danger	UN#: 2811
Class : 6.1	Packing Group : Ⅲ
Hazard Statements : H301-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 53.33
LogP 1.97908
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Cyanide/Nitrile

Building Blocks Skeleton Aromatic heterocycle compounds Other aromatic heterocycles compounds

Key Words

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3-(6-Chloro-3-oxo-2,3-dihydro-4H-benzo[b][1,4]oxazin-4-yl)propanenitrile

CAS No. 351003-20-8

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