Ethyl 2-(3-nitro-1H-1,2,4-triazol-1-yl)butanoate

Name: Ethyl 2-(3-nitro-1H-1,2,4-triazol-1-yl)butanoate
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CAS No. 1341199-88-9
Cat. No. CS-0548163
Molecule weight228.21
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+
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
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Ethyl 2-(3-nitro-1H-1,2,4-triazol-1-yl)butanoate|CS-0548163

Structure of 1341199-88-9

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General Information

CAS No. 1341199-88-9
Cat. No. CS-0548163
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₁₂N₄O₄
Molecular Weight 228.21
Synonym(s) 1H-1,2,4-Triazole-1-acetic acid, α-ethyl-3-nitro-, ethyl ester
SMILES O=C(OCC)C(N1N=C(N=C1)N(=O)=O)CC

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 100.15
LogP 0.7005
H_Acceptors 7
H_Donors 0
Rotatable_Bonds 5

Other Classifications

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic heterocycle compounds Triazole compounds

Key Words

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Ethyl 2-(3-nitro-1H-1,2,4-triazol-1-yl)butanoate

CAS No. 1341199-88-9

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