N-(2-amino-4-methylphenyl)isobutyramide

Name: N-(2-amino-4-methylphenyl)isobutyramide
Brand: ChemScene
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CAS No. 649763-42-8
Cat. No. CS-0322721
Molecule weight192.26
Purity95+%
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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N-(2-amino-4-methylphenyl)isobutyramide|CS-0322721

Structure of 649763-42-8

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General Information

CAS No. 649763-42-8
Cat. No. CS-0322721
Purity 95+%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₁₆N₂O
Molecular Weight 192.26
Synonym(s) N-(2-Amino-4-methylphenyl)-2-methylpropanamide
SMILES CC(C(NC1=C(N)C=C(C=C1)C)=O)C

Synthesis

Route1
- 330469-35-7
- ~62%
- 649763-42-8
References
- Legrand, Yves-Marie; Gray, Mark; Cooke, Graeme; Rotello, Vincent M. Journal of the American Chemical Society, 2003 , vol. 125, # 51 p. 15789 - 15795
Route2
- 89-62-3
- ~%
- 649763-42-8
References
- Legrand, Yves-Marie; Gray, Mark; Cooke, Graeme; Rotello, Vincent M. Journal of the American Chemical Society, 2003 , vol. 125, # 51 p. 15789 - 15795

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

Quality Control

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Computational Chemistry Data

TPSA 55.12
LogP 2.17172
H_Acceptors 2
H_Donors 2
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Amide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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N-(2-amino-4-methylphenyl)isobutyramide

CAS No. 649763-42-8

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