Cas no 7146-69-2 ( )
structure
Product Name:
CAS No:7146-69-2
MF:C19H22N2O3S
MW:358.454583644867
CID:976425
PubChem ID:229832
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- 1-(4-methylphenyl)sulfonyl-4-phenylpiperidine-4-carboxamide
- 1-[(4-methylphenyl)sulfonyl]-4-phenylpiperidine-4-carboxamide
- AC1L5I6J
- AC1Q6U2A
- AR-1B8725
- CTK5D4205
- KST-1B9224
- NSC23834
- NSC-23834
- 7146-69-2
- DTXSID10282017
- 1-(4-Methylbenzene-1-sulfonyl)-4-phenylpiperidine-4-carboxamide
-
-
- Inchi： 1S/C19H22N2O3S/c1-15-7-9-17(10-8-15)25(23,24)21-13-11-19(12-14-21,18(20)22)16-5-3-2-4-6-16/h2-10H,11-14H2,1H3,(H2,20,22)
- InChI Key： KMBCGVPVLJYLRE-UHFFFAOYSA-N
- SMILES： S(C1C=CC(C)=CC=1)(N1CCC(C(N)=O)(C2C=CC=CC=2)CC1)(=O)=O
Computed Properties
- Exact Mass: 358.13526
- Monoisotopic Mass: 358.135
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 25
- Rotatable Bond Count: 4
- Complexity: 562
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.3
- Topological Polar Surface Area: 88.8?2
Experimental Properties
- Density: 1.27
- Boiling Point: 584.5°C at 760 mmHg
- Flash Point: 307.3°C
- Refractive Index: 1.613
- PSA: 80.47
- LogP: 3.92180
Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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