Cas no 67950-96-3 (CYCLOHEPTANEACETIC ACID, 1-CARBOXY-)
67950-96-3 structure
Product Name:CYCLOHEPTANEACETIC ACID, 1-CARBOXY-
CAS No:67950-96-3
MF:C10H16O4
MW:200.231643676758
CID:3413614
PubChem ID:2807272
Update Time:2025-04-21
CYCLOHEPTANEACETIC ACID, 1-CARBOXY- Chemical and Physical Properties
Names and Identifiers
-
- CYCLOHEPTANEACETIC ACID, 1-CARBOXY-
- 67950-96-3
- DTXSID601301512
- 1-Carboxycycloheptaneacetic acid
- Oprea1_510812
-
- Inchi: 1S/C10H16O4/c11-8(12)7-10(9(13)14)5-3-1-2-4-6-10/h1-7H2,(H,11,12)(H,13,14)
- InChI Key: PKADOCGFNYVGOP-UHFFFAOYSA-N
- SMILES: C1(C(O)=O)(CC(O)=O)CCCCCC1
Computed Properties
- Exact Mass: 200.10485899Da
- Monoisotopic Mass: 200.10485899Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 226
- 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: 1.7
- Topological Polar Surface Area: 74.6?2
CYCLOHEPTANEACETIC ACID, 1-CARBOXY- Related Literature
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
-
Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
-
Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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