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CAS No.: | 100462-43-9 |
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Name: | SUCCINIC ACID-MONO-N-PHENYLSULFONYLAMIDE |
Molecular Structure: | |
Formula: | C10H11NO5S |
Molecular Weight: | 257.267 |
Synonyms: | Succinic acid-mono-N-phenylsulfonylamide;4-(Benzenesulfonamido)-4-oxo-butanoic acid;4-Oxo-4-[(phenylsulfonyl)amino]butanoic acid; |
Density: | 1.419 g/cm3 |
PSA: | 108.92000 |
LogP: | 1.82800 |
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The Butanoic acid,4-oxo-4-[(phenylsulfonyl)amino]-, with the CAS registry number of 100462-43-9, is also known as Succinic acid-mono-N-phenylsulfonylamide. The molecular formula of this chemical is C10H11NO5S and its molecular weight is 257.263. What's more, its systematic name is 4-(Benzenesulfonamido)-4-oxo-butanoic acid.
Physical properties about Butanoic acid,4-oxo-4-[(phenylsulfonyl)amino]- are: (1)# of Rule of 5 Violations: 0; (2)#H bond acceptors: 6; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 4; (5)Polar Surface Area: 108.92 Å2; (6)Index of Refraction: 1.57; (7)Molar Refractivity: 59.51 cm3; (8)Molar Volume: 181.2 cm3; (9)Polarizability: 23.59×10-24 cm3; (10)Surface Tension: 57.4 dyne/cm; (11)Density: 1.419 g/cm3.
You can still convert the following datas into molecular structure:
(1) SMILES: O=S(=O)(NC(=O)CCC(O)=O)c1ccccc1
(2) InChI: InChI=1/C10H11NO5S/c12-9(6-7-10(13)14)11-17(15,16)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)(H,13,14)
(3) InChIKey: NVDKGZPVBHGXEZ-UHFFFAOYAR