Cas no 5446-24-2 (Ethanone,1-[3-(acetyloxy)-6-chloro-2-methyl-1H-indol-1-yl]-)
![Ethanone,1-[3-(acetyloxy)-6-chloro-2-methyl-1H-indol-1-yl]- structure](https://ossimg.kuujia.com/scimg/5500/5446-24-2x500.png)
5446-24-2 structure
Product Name:Ethanone,1-[3-(acetyloxy)-6-chloro-2-methyl-1H-indol-1-yl]-
CAS No:5446-24-2
MF:C13H12ClNO3
MW:265.692282676697
CID:371529
PubChem ID:226583
Update Time:2025-04-19
Ethanone,1-[3-(acetyloxy)-6-chloro-2-methyl-1H-indol-1-yl]- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone,1-[3-(acetyloxy)-6-chloro-2-methyl-1H-indol-1-yl]-
- (1-acetyl-6-chloro-2-methyl-indol-3-yl) acetate
- (1-acetyl-6-chloro-2-methylindol-3-yl) acetate
- 1-Acetyl-6-chlor-2-methyl-indoxyl-acetat
- 1-acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate
- 3-acetoxy-1-acetyl-6-chloro-2-methyl-1H-indole
- 3-acetoxy-1-acetyl-6-chloro-2-methyl-indole
- AC1L5EVH
- AC1Q3OQW
- AG-J-36577
- AR-1C1338
- CTK5A1125
- NSC17193
- DTXSID20280504
- NSC-17193
- 5446-24-2
-
- Inchi： 1S/C13H12ClNO3/c1-7-13(18-9(3)17)11-5-4-10(14)6-12(11)15(7)8(2)16/h4-6H,1-3H3
- InChI Key： AMJQQQTXFVFJHB-UHFFFAOYSA-N
- SMILES： ClC1C=CC2C(=C(C)N(C(C)=O)C=2C=1)OC(C)=O
Computed Properties
- Exact Mass: 265.05066
- Monoisotopic Mass: 265.0505709g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 360
- 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: 2.7
- Topological Polar Surface Area: 48.3?2
Experimental Properties
- PSA: 48.3
Ethanone,1-[3-(acetyloxy)-6-chloro-2-methyl-1H-indol-1-yl]- Related Literature
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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