N-benzyl-3-(1H-imidazol-1-yl)propan-1-amine

Name: N-benzyl-3-(1H-imidazol-1-yl)propan-1-amine
Brand: ChemScene
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CAS No. 112086-52-9
Cat. No. CS-0329591
Purity≥97%
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-benzyl-3-(1H-imidazol-1-yl)propan-1-amine|CS-0329591

Structure of 112086-52-9

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General Information

CAS No. 112086-52-9
Cat. No. CS-0329591
Purity ≥97%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₃H₁₇N₃
Molecular Weight 215.29
Synonym(s) N-benzyl-3-imidazol-1-ylpropan-1-amine
SMILES C1=CC=C(C=C1)CNCCCN2C=CN=C2

Synthesis

Route1
- In-stock
  
  5036-48-6
- 100-52-7
- ~%
- 112086-52-9
References
- Roman, Gheorghe Journal of the Serbian Chemical Society, 2012 , vol. 77, # 2 p. 131 - 140
Route2
- 820220-10-8
- ~%
- 112086-52-9
References
- Roman, Gheorghe Journal of the Serbian Chemical Society, 2012 , vol. 77, # 2 p. 131 - 140

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 29.85
LogP 2.063
H_Acceptors 3
H_Donors 1
Rotatable_Bonds 6

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Imidazole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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N-benzyl-3-(1H-imidazol-1-yl)propan-1-amine

CAS No. 112086-52-9

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