Cas no 61318-32-9 (Benzenesulfonyl chloride, 4-[(1-oxododecyl)amino]-)
61318-32-9 structure
Product Name:Benzenesulfonyl chloride, 4-[(1-oxododecyl)amino]-
CAS No:61318-32-9
MF:C18H28ClNO3S
MW:373.937823295593
CID:484316
PubChem ID:71396957
Update Time:2025-04-19
Benzenesulfonyl chloride, 4-[(1-oxododecyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonyl chloride, 4-[(1-oxododecyl)amino]-
- 4-(dodecanoylamino)benzenesulfonyl chloride
- 61318-32-9
- DTXSID30818478
- 4-(Dodecanoylamino)benzene-1-sulfonyl chloride
-
- Inchi: 1S/C18H28ClNO3S/c1-2-3-4-5-6-7-8-9-10-11-18(21)20-16-12-14-17(15-13-16)24(19,22)23/h12-15H,2-11H2,1H3,(H,20,21)
- InChI Key: AMBOQKWXOMWDFP-UHFFFAOYSA-N
- SMILES: ClS(C1C=CC(=CC=1)NC(CCCCCCCCCCC)=O)(=O)=O
Computed Properties
- Exact Mass: 373.14804
- Monoisotopic Mass: 373.1478426g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 24
- Rotatable Bond Count: 12
- Complexity: 440
- 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: 6.3
- Topological Polar Surface Area: 71.6?2
Experimental Properties
- PSA: 63.24
Benzenesulfonyl chloride, 4-[(1-oxododecyl)amino]- Related Literature
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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