Cas no 30057-03-5 (Carbanilic acid,p-(dimethylsulfamoyl)-, cyclohexyl ester (8CI))
30057-03-5 structure
Product Name:Carbanilic acid,p-(dimethylsulfamoyl)-, cyclohexyl ester (8CI)
CAS No:30057-03-5
MF:C15H22N2O4S
MW:326.411182880402
CID:312977
PubChem ID:270138
Update Time:2025-04-19
Carbanilic acid,p-(dimethylsulfamoyl)-, cyclohexyl ester (8CI) Chemical and Physical Properties
Names and Identifiers
-
- Carbanilic acid,p-(dimethylsulfamoyl)-, cyclohexyl ester (8CI)
- Cyclohexyl [4-(dimethylsulfamoyl)phenyl]carbamate
- 30057-03-5
- NSC112331
- NSC-112331
- DTXSID00952459
-
- Inchi： 1S/C15H22N2O4S/c1-17(2)22(19,20)14-10-8-12(9-11-14)16-15(18)21-13-6-4-3-5-7-13/h8-11,13H,3-7H2,1-2H3,(H,16,18)
- InChI Key： DKKJHVAAHDJDBP-UHFFFAOYSA-N
- SMILES： S(C1C=CC(=CC=1)NC(=O)OC1CCCCC1)(N(C)C)(=O)=O
Computed Properties
- Exact Mass: 326.13016
- Monoisotopic Mass: 326.130028
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 22
- Rotatable Bond Count: 5
- Complexity: 458
- 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
- Topological Polar Surface Area: 84.1
- XLogP3: 2.5
Experimental Properties
- Density: 1.27
- Refractive Index: 1.574
- PSA: 75.71
- LogP: 3.97190
Carbanilic acid,p-(dimethylsulfamoyl)-, cyclohexyl ester (8CI) Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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