3-((4-Cyanophenyl)amino)-3-oxopropanoic acid

Name: 3-((4-Cyanophenyl)amino)-3-oxopropanoic acid
Brand: ChemScene
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CAS No. 1100767-21-2
Cat. No. CS-0440861
Molecule weight204.18
Purity≥98%
MDL No.None

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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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3-((4-Cyanophenyl)amino)-3-oxopropanoic acid|CS-0440861

Structure of 1100767-21-2

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General Information

CAS No. 1100767-21-2
Cat. No. CS-0440861
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₈N₂O₃
Molecular Weight 204.18
Synonym(s) N-(4-cyano-phenyl)-malonamic acid
SMILES C1=C(C=CC(=C1)NC(=O)CC(=O)O)C#N

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 90.19
LogP 0.97148
H_Acceptors 3
H_Donors 2
Rotatable_Bonds 3

Other Classifications

Building Blocks Functional Group Carboxylic Acid

Building Blocks Functional Group Amide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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3-((4-Cyanophenyl)amino)-3-oxopropanoic acid

CAS No. 1100767-21-2

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