9-Chloro-3,4-dihydro-2h-1,5-benzodioxepine-7-carbonitrile

Name: 9-Chloro-3,4-dihydro-2h-1,5-benzodioxepine-7-carbonitrile
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CAS No. 855991-54-7
Cat. No. CS-0233717
Molecule weight209.63
Purity≥95%
MDL No.None

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9-Chloro-3,4-dihydro-2h-1,5-benzodioxepine-7-carbonitrile|CS-0233717

Structure of 855991-54-7

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General Information

CAS No. 855991-54-7
Cat. No. CS-0233717
Purity ≥95%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₈ClNO₂
Molecular Weight 209.63
Synonym(s) None
SMILES N#CC1=CC(Cl)=C(OCCCO2)C2=C1

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 42.25
LogP 2.37298
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 0

Other Classifications

Building Blocks Functional Group Cyanide/Nitrile

Building Blocks Skeleton Aromatic heterocycle compounds Other aromatic heterocycles compounds

Key Words

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9-Chloro-3,4-dihydro-2h-1,5-benzodioxepine-7-carbonitrile

CAS No. 855991-54-7

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