(3R,5R)-1-Benzyl-3,5-dimethylpiperazine

Name: (3R,5R)-1-Benzyl-3,5-dimethylpiperazine
Brand: ChemScene
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CAS No. 170211-03-7
Cat. No. CS-0001871
Purity≥98%
MDL No.MFCD11973746

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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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(3R,5R)-1-Benzyl-3,5-dimethylpiperazine|CS-0001871

Structure of 170211-03-7

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General Information

CAS No. 170211-03-7
Cat. No. CS-0001871
Purity ≥98%
MDL No. MFCD11973746
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₃H₂₀N₂
Molecular Weight 204.31
Synonym(s) Piperazine, 3,5-diMethyl-1-(phenylMethyl)-, (3R,5R)- (or Piperazine, 3,5-diMethyl-1-(phenylMethyl)-, (3R-trans)-)
SMILES C[C@@H]1CN(CC2=CC=CC=C2)C[C@@H](C)N1

Synthesis

Route1
- 162240-92-8
- ~96%
- 170211-03-7
References
- Mickelson, John W.; Belonga, Kenneth L.; Jacobsen, Jon E. Journal of Organic Chemistry, 1995 , vol. 60, # 13 p. 4177 - 4183
Route2
- 74474-93-4
- ~%
- 170211-03-7
References
- Hong, Qingmei; Bakshi, Raman K.; Palucki, Brenda L.; Park, Min K.; Ye, Zhixiong; He, Shuwen; Pollard, Patrick G.; Sebhat, Iyassu K.; Liu, Jian; Guo, Liangqin; Cashen, Doreen E.; Martin, William J.; Weinberg, David H.; MacNeil, Tanya; Tang, Rui; Tamvakopoulos, Constantin; Peng, Qianping; Miller, Randy R.; Stearns, Ralph A.; Chen, Howard Y.; Chen, Airu S.; Strack, Alison M.; Fong, Tung M.; MacIntyre, D. Euan; Wyvratt, Matthew J.; Nargund, Ravi P. Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 8 p. 2330 - 2334
Route3
- 674792-11-1
- ~%
- 170211-03-7
References
- Hong, Qingmei; Bakshi, Raman K.; Palucki, Brenda L.; Park, Min K.; Ye, Zhixiong; He, Shuwen; Pollard, Patrick G.; Sebhat, Iyassu K.; Liu, Jian; Guo, Liangqin; Cashen, Doreen E.; Martin, William J.; Weinberg, David H.; MacNeil, Tanya; Tang, Rui; Tamvakopoulos, Constantin; Peng, Qianping; Miller, Randy R.; Stearns, Ralph A.; Chen, Howard Y.; Chen, Airu S.; Strack, Alison M.; Fong, Tung M.; MacIntyre, D. Euan; Wyvratt, Matthew J.; Nargund, Ravi P. Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 8 p. 2330 - 2334

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

TPSA 15.27
LogP 1.8688
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 2

Other Classifications

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Building Blocks Skeleton Chiral compounds Chiral Building Blocks

Key Words

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(3R,5R)-1-Benzyl-3,5-dimethylpiperazine

CAS No. 170211-03-7

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