Cas no 84409-29-0 (3-oxo-1-phenylcyclopentanecarboxylic acid)
84409-29-0 structure
Product Name:3-oxo-1-phenylcyclopentanecarboxylic acid
CAS No:84409-29-0
MF:C12H12O3
MW:204.221883773804
CID:2106275
PubChem ID:655176
Update Time:2025-04-21
3-oxo-1-phenylcyclopentanecarboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- 3-oxo-1-phenylcyclopentanecarboxylic acid
- AKOS022139483
- SMR000009429
- STL297935
- 3-keto-1-phenyl-cyclopentanecarboxylic acid
- DA-02460
- TimTec1_007337
- 3-oxo-1-phenylcyclopentan-1-carboxylic
- AKOS000547910
- Oprea1_876011
- CHEMBL1408167
- 3-oxo-1-phenylcyclopentane-1-carboxylic acid
- BDBM41760
- Oprea1_392977
- 3-oxidanylidene-1-phenyl-cyclopentane-1-carboxylic acid
- cid_655176
- 3-Oxo-1-phenyl-cyclopentanecarboxylic acid
- 84409-29-0
- SCHEMBL13226486
- HMS2298O13
- 3-oxo-1-phenyl-1-cyclopentanecarboxylic acid
- MLS000032541
- HMS1554N11
-
- Inchi： 1S/C12H12O3/c13-10-6-7-12(8-10,11(14)15)9-4-2-1-3-5-9/h1-5H,6-8H2,(H,14,15)
- InChI Key： GZFDVSDSPLDDJS-UHFFFAOYSA-N
- SMILES： O=C1CCC(C(=O)O)(C2C=CC=CC=2)C1
Computed Properties
- Exact Mass: 204.078644241Da
- Monoisotopic Mass: 204.078644241Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 279
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.1
- Topological Polar Surface Area: 54.4?2
3-oxo-1-phenylcyclopentanecarboxylic acid Related Literature
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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