4-Piperidinone,1,3,5-trimethyl-2,6-diphenyl-(CAS No. 5554-59-6) CAS NO.5554-59-6

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Product Details

Keywords

4-Piperidinone,1,3,5-trimethyl-2,6-diphenyl-
5554-59-6
98%

Quick Details

ProName: 4-Piperidinone,1,3,5-trimethyl-2,6-dip...
CasNo: 5554-59-6
Molecular Formula: C20H23 N O
Appearance: Solid
Application: Organic Chemicals
DeliveryTime: according to client's demand quantity
PackAge: as requested
Port: SHANGHAI
ProductionCapacity: 100 Kilogram/Month
Purity: 99%
Storage: room temperature
Transportation: as requested
LimitNum: 1 Kilogram

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Details

【Name】
4-Piperidinone,1,3,5-trimethyl-2,6-diphenyl-
【CAS Registry number】
5554-59-6
【Synonyms】
4-Piperidone,1,3,5-trimethyl-2,6-diphenyl- (6CI,7CI,8CI)
1,3,5-Trimethyl-2,6-diphenylpiperidin-4-one
NSC 364025
NSC 364080
【Molecular Formula】
C20H23 N O (Products with the same molecular formula)
【Molecular Weight】
234.29422
【Inchi】
InChI=1S/C13H18N2O2/c16-15(17)13-8-4-5-11(9-13)10-14-12-6-2-1-3-7-12/h4-5,8-9,12,14H,1-3,6-7,10H2
【Canonical SMILES】
C1CCC(CC1)NCC2=CC(=CC=C2)[N+](=O)[O-]
Chemical and Physical Properties
【Computed Properties】
Molecular Weight:234.29422 [g/mol]
Molecular Formula:C13H18N2O2
XLogP3:3.3
H-Bond Donor:1
H-Bond Acceptor:3
Rotatable Bond Count:3
Exact Mass:234.136828
MonoIsotopic Mass:234.136828
Topological Polar Surface Area:57.8
Heavy Atom Count:17
Formal Charge:0
Complexity:246
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:2
Feature 3D Donor Count:1
Feature 3D Anion Count:1
Feature 3D Cation Count:1
Feature 3D Ring Count:2
Effective Rotor Count:5.2
Conformer Sampling RMSD:0.6
CID Conformer Count:46

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