tert-Butyl 4-(2-bromophenyl)-4-cyanopiperidine-1-carboxylate

Name: tert-Butyl 4-(2-bromophenyl)-4-cyanopiperidine-1-carboxylate
Brand: ChemScene
Availability: OutOfStock
Rating: 5 (1 reviews)

CAS No. 920023-51-4
Cat. No. CS-0171745
Molecule weight365.26
Purity≥95%
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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tert-Butyl 4-(2-bromophenyl)-4-cyanopiperidine-1-carboxylate|CS-0171745

Structure of 920023-51-4

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General Information

CAS No. 920023-51-4
Cat. No. CS-0171745
Purity ≥95%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₇H₂₁BrN₂O₂
Molecular Weight 365.26
Synonym(s) N-BOC-4-(2-BROMOPHENYL)-4-CYANOPIPERIDINE
SMILES CC(C)(C)OC(=O)N1CCC(CC1)(C#N)C2=CC=CC=C2Br

Synthesis

Route1
- 118753-70-1
- ~77%
- 920023-51-4
References
- Bissantz, Caterina; Grundschober, Christophe; Ratni, Hasane; Rogers-Evans, Mark; Schnider, Patrick Patent: US2007/27173 A1, 2007 ; Location in patent: Page/Page column 115-116 ; US 20070027173 A1
Route2
- 19472-74-3
- 118753-70-1
- ~59%
- 920023-51-4
References
- SCHERING CORPORATION; BOGEN, Stephane, L.; MA, Yao; WANG, Yaolin; LAHUE, Brian Robert; NAIR, Latha, G.; SHIZUKA, Manami; VOSS, Matthew Ernst; KIROVA-SNOVER, Margarita; PAN, Weidong; TIAN, Yuan; KULKARNI, Bheemashankar, A.; GIBEAU, Craig, R.; LIU, Yuan; SCAPIN, Giovanna; RINDGEN, Diane; DOLL, Ronald, J.; GUZI, Timothy, J.; HICKLIN, Danny, J.; NOMEIR, Amin; SEIDEL-DUGAN, Cynthia; SHIPPS, Gerald, W., Jr.; MACCOSS, Malcolm Patent: WO2011/46771 A1, 2011 ; Location in patent: Page/Page column 139-140 ; WO 2011/046771 A1
Route3
- In-stock
  
  24424-99-5
- ~%
- 920023-51-4
References
- SCHERING CORPORATION; BOGEN, Stephane, L.; MA, Yao; WANG, Yaolin; LAHUE, Brian Robert; NAIR, Latha, G.; SHIZUKA, Manami; VOSS, Matthew Ernst; KIROVA-SNOVER, Margarita; PAN, Weidong; TIAN, Yuan; KULKARNI, Bheemashankar, A.; GIBEAU, Craig, R.; LIU, Yuan; SCAPIN, Giovanna; RINDGEN, Diane; DOLL, Ronald, J.; GUZI, Timothy, J.; HICKLIN, Danny, J.; NOMEIR, Amin; SEIDEL-DUGAN, Cynthia; SHIPPS, Gerald, W., Jr.; MACCOSS, Malcolm Patent: WO2011/46771 A1, 2011 ; WO 2011/046771 A1

Safety Information

Download SDS

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 53.33
LogP 4.24138
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Cyanide/Nitrile

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aliphatic heterocycle compounds Piperidine compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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tert-Butyl 4-(2-bromophenyl)-4-cyanopiperidine-1-carboxylate

CAS No. 920023-51-4

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