Cas no 5617-86-7 (Cyclopropaneheptanoic acid)
Cyclopropaneheptanoic acid structure
Product Name:Cyclopropaneheptanoic acid
CAS No:5617-86-7
MF:C10H18O2
MW:170.248723506927
CID:349568
PubChem ID:16114137
Update Time:2025-04-19
Cyclopropaneheptanoic acid Chemical and Physical Properties
Names and Identifiers
-
- Cyclopropaneheptanoic acid
- 7-cyclopropylheptanoic acid
- 5617-86-7
- SCHEMBL4449247
- IFZAIZAFLMXIKG-UHFFFAOYSA-N
- DTXSID30583013
-
- Inchi： 1S/C10H18O2/c11-10(12)6-4-2-1-3-5-9-7-8-9/h9H,1-8H2,(H,11,12)
- InChI Key： IFZAIZAFLMXIKG-UHFFFAOYSA-N
- SMILES： OC(CCCCCCC1CC1)=O
Computed Properties
- Exact Mass: 170.13074
- Monoisotopic Mass: 170.130679813g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 7
- Complexity: 139
- 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: 3.6
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.3
Cyclopropaneheptanoic acid Related Literature
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
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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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Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
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5. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
5617-86-7 (Cyclopropaneheptanoic acid) Related Products
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- 646-07-1(4-Methylpentanoic acid)
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- 1730-92-3((3S)-3-methylpentanoic acid)
- 3058-01-3(3-Methyladipic acid)
- 105-43-1(3-methylpentanoic acid)
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