3-{5,6-dimethyl-4-oxo-3h,4h-thieno[2,3-d]pyrimidin-3-yl}propanenitrile

Name: 3-{5,6-dimethyl-4-oxo-3h,4h-thieno[2,3-d]pyrimidin-3-yl}propanenitrile
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CAS No. 890007-57-5
Cat. No. CS-0222376
Purity≥98%
MDL No.None

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3-{5,6-dimethyl-4-oxo-3h,4h-thieno[2,3-d]pyrimidin-3-yl}propanenitrile|CS-0222376

Structure of 890007-57-5

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General Information

CAS No. 890007-57-5
Cat. No. CS-0222376
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₁₁N₃OS
Molecular Weight 233.29
Synonym(s) None
SMILES N#CCCN(C=NC1=C2C(C)=C(C)S1)C2=O

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 58.68
LogP 1.98852
H_Acceptors 5
H_Donors 0
Rotatable_Bonds 2

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Pyrimidine compounds

Building Blocks Skeleton Aromatic heterocycle compounds Thiophene compounds

Key Words

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3-{5,6-dimethyl-4-oxo-3h,4h-thieno[2,3-d]pyrimidin-3-yl}propanenitrile

CAS No. 890007-57-5

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