Cas no 87687-00-1 (3H-Phenoxazin-3-one, 7-(heptyloxy)-)
87687-00-1 structure
Product Name:3H-Phenoxazin-3-one, 7-(heptyloxy)-
CAS No:87687-00-1
MF:C19H21NO3
MW:311.374945402145
CID:653515
PubChem ID:11066909
Update Time:2025-04-19
3H-Phenoxazin-3-one, 7-(heptyloxy)- Chemical and Physical Properties
Names and Identifiers
-
- 3H-Phenoxazin-3-one, 7-(heptyloxy)-
- 7-heptoxyphenoxazin-3-one
- 87687-00-1
- DTXSID10454030
-
- Inchi： 1S/C19H21NO3/c1-2-3-4-5-6-11-22-15-8-10-17-19(13-15)23-18-12-14(21)7-9-16(18)20-17/h7-10,12-13H,2-6,11H2,1H3
- InChI Key： HXVNQNXNSREMOW-UHFFFAOYSA-N
- SMILES： O(C1=CC=C2C(=C1)OC1=CC(C=CC1=N2)=O)CCCCCCC
Computed Properties
- Exact Mass: 311.15214353g/mol
- Monoisotopic Mass: 311.15214353g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 23
- Rotatable Bond Count: 7
- Complexity: 521
- 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: 4.3
- Topological Polar Surface Area: 47.9?2
3H-Phenoxazin-3-one, 7-(heptyloxy)- Related Literature
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Felix Witte,Philipp Rietsch,Nithiya Nirmalananthan-Budau,Florian Weigert,Jan P. G?tze,Ute Resch-Genger,Siegfried Eigler,Beate Paulus Phys. Chem. Chem. Phys., 2021,23, 17521-17529
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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