4-((6-Oxo-1,6-dihydropyrimidin-2-yl)amino)benzonitrile

Name: 4-((6-Oxo-1,6-dihydropyrimidin-2-yl)amino)benzonitrile
Brand: ChemScene
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CAS No. 189956-45-4
Cat. No. CS-0006974
Purity≥98%
MDL No.MFCD08443716

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Type	HazMat Fee
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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4-((6-Oxo-1,6-dihydropyrimidin-2-yl)amino)benzonitrile|CS-0006974

Structure of 189956-45-4

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General Information

CAS No. 189956-45-4
Cat. No. CS-0006974
Purity ≥98%
MDL No. MFCD08443716
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₈N₄O
Molecular Weight 212.21
Synonym(s) None
SMILES O=C1CC=NC(NC2=CC=C(C#N)C=C2)=N1

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS05
Signal Word : Danger	UN#: 1759
Class : 8	Packing Group : Ⅲ
Hazard Statements : H318
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501

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Computational Chemistry Data

TPSA 77.61
LogP 1.32728
H_Acceptors 4
H_Donors 1
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Guanidine

Building Blocks Functional Group Cyanide/Nitrile

Building Blocks Functional Group Amide

Building Blocks Skeleton Aliphatic heterocycle compounds Other aliphatic heterocycles compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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4-((6-Oxo-1,6-dihydropyrimidin-2-yl)amino)benzonitrile

CAS No. 189956-45-4

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