Cas no 42569-41-5 (1-Cyclohexene-1-carboxylic acid, 4-(1-hydroxyethyl)- (9CI))
42569-41-5 structure
Product Name:1-Cyclohexene-1-carboxylic acid, 4-(1-hydroxyethyl)- (9CI)
CAS No:42569-41-5
MF:C9H14O3
MW:170.205663204193
CID:325192
PubChem ID:45116561
Update Time:2025-04-19
1-Cyclohexene-1-carboxylic acid, 4-(1-hydroxyethyl)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1-Cyclohexene-1-carboxylic acid, 4-(1-hydroxyethyl)- (9CI)
- 1-Cyclohexene-1-carboxylicacid, 4-(1-hydroxyethyl)-
- 4-(1-hydroxyethyl)cyclohexene-1-carboxylic acid
- 4-(1-Hydroxyethyl)cyclohex-1-ene-1-carboxylic acid
- DTXSID90668456
- 42569-41-5
-
- Inchi： 1S/C9H14O3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h4,6-7,10H,2-3,5H2,1H3,(H,11,12)
- InChI Key： LSKQNLMXXIHYEE-UHFFFAOYSA-N
- SMILES： OC(C)C1CC=C(C(=O)O)CC1
Computed Properties
- Exact Mass: 170.094
- Monoisotopic Mass: 170.094
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 208
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 57.5A^2
- XLogP3: 1
1-Cyclohexene-1-carboxylic acid, 4-(1-hydroxyethyl)- (9CI) Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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