Cas no 918503-27-2 (7-Nonenoic acid, 2,2-dichloro-8-methyl-3-oxo-, ethyl ester)
918503-27-2 structure
Product Name:7-Nonenoic acid, 2,2-dichloro-8-methyl-3-oxo-, ethyl ester
CAS No:918503-27-2
MF:C12H18Cl2O3
MW:281.175522327423
CID:774210
PubChem ID:71426960
Update Time:2025-04-19
7-Nonenoic acid, 2,2-dichloro-8-methyl-3-oxo-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 7-Nonenoic acid, 2,2-dichloro-8-methyl-3-oxo-, ethyl ester
- ethyl 2,2-dichloro-8-methyl-3-oxonon-7-enoate
- DTXSID60845712
- 918503-27-2
-
- Inchi： 1S/C12H18Cl2O3/c1-4-17-11(16)12(13,14)10(15)8-6-5-7-9(2)3/h7H,4-6,8H2,1-3H3
- InChI Key： VXNFWCRVOMDZRY-UHFFFAOYSA-N
- SMILES： ClC(C(=O)OCC)(C(CCC/C=C(\C)/C)=O)Cl
Computed Properties
- Exact Mass: 280.0632998g/mol
- Monoisotopic Mass: 280.0632998g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 8
- Complexity: 305
- 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: 3.8
- Topological Polar Surface Area: 43.4?2
7-Nonenoic acid, 2,2-dichloro-8-methyl-3-oxo-, ethyl ester Related Literature
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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