Cas no 88963-70-6 (1,3-Naphthalenedisulfonic acid, 8-(acetylamino)-)
88963-70-6 structure
Product Name:1,3-Naphthalenedisulfonic acid, 8-(acetylamino)-
CAS No:88963-70-6
MF:C12H11NO7S2
MW:345.348241090775
CID:617955
PubChem ID:71321014
Update Time:2025-04-19
1,3-Naphthalenedisulfonic acid, 8-(acetylamino)- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Naphthalenedisulfonic acid, 8-(acetylamino)-
- 8-acetamidonaphthalene-1,3-disulfonic acid
- DTXSID40750875
- 88963-70-6
-
- Inchi： 1S/C12H11NO7S2/c1-7(14)13-10-4-2-3-8-5-9(21(15,16)17)6-11(12(8)10)22(18,19)20/h2-6H,1H3,(H,13,14)(H,15,16,17)(H,18,19,20)
- InChI Key： XDRSCOTWUIQDAH-UHFFFAOYSA-N
- SMILES： S(C1C=C(C=C2C=CC=C(C2=1)NC(C)=O)S(=O)(=O)O)(=O)(=O)O
Computed Properties
- Exact Mass: 344.99769404g/mol
- Monoisotopic Mass: 344.99769404g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 22
- Rotatable Bond Count: 3
- Complexity: 631
- 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: -0.2
- Topological Polar Surface Area: 155?2
1,3-Naphthalenedisulfonic acid, 8-(acetylamino)- Related Literature
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
88963-70-6 (1,3-Naphthalenedisulfonic acid, 8-(acetylamino)-) Related Products
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