Cas no 62310-18-3 (Benzoic acid, 5-[(diethylamino)sulfonyl]-2-(phenylamino)-)
![Benzoic acid, 5-[(diethylamino)sulfonyl]-2-(phenylamino)- structure](https://ossimg.kuujia.com/scimg/62500/62310-18-3x500.png)
62310-18-3 structure
Product Name:Benzoic acid, 5-[(diethylamino)sulfonyl]-2-(phenylamino)-
CAS No:62310-18-3
MF:C17H20N2O4S
MW:348.416703224182
CID:449811
PubChem ID:12308436
Update Time:2025-04-19
Benzoic acid, 5-[(diethylamino)sulfonyl]-2-(phenylamino)- Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 5-[(diethylamino)sulfonyl]-2-(phenylamino)-
- 2-anilino-5-(diethylsulfamoyl)benzoic acid
- 62310-18-3
- DTXSID40487154
-
- Inchi： 1S/C17H20N2O4S/c1-3-19(4-2)24(22,23)14-10-11-16(15(12-14)17(20)21)18-13-8-6-5-7-9-13/h5-12,18H,3-4H2,1-2H3,(H,20,21)
- InChI Key： RLAGFXYGEVYYEI-UHFFFAOYSA-N
- SMILES： S(C1C=CC(=C(C(=O)O)C=1)NC1C=CC=CC=1)(N(CC)CC)(=O)=O
Computed Properties
- Exact Mass: 348.1145
- Monoisotopic Mass: 348.11437830g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 24
- Rotatable Bond Count: 7
- Complexity: 507
- 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: 3.4
- Topological Polar Surface Area: 95.1?2
Experimental Properties
- PSA: 86.71
Benzoic acid, 5-[(diethylamino)sulfonyl]-2-(phenylamino)- Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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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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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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