Cas no 14557-88-1 (2-Naphthalenecarboxylicacid, 1,2,3,4-tetrahydro-4,5,8-trimethyl-)
14557-88-1 structure
Product Name:2-Naphthalenecarboxylicacid, 1,2,3,4-tetrahydro-4,5,8-trimethyl-
CAS No:14557-88-1
MF:C14H18O2
MW:218.291524410248
CID:219099
PubChem ID:283763
Update Time:2025-04-19
2-Naphthalenecarboxylicacid, 1,2,3,4-tetrahydro-4,5,8-trimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Naphthalenecarboxylicacid, 1,2,3,4-tetrahydro-4,5,8-trimethyl-
- 4,5,8-trimethyl-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
- 4,5,8-Trimethyl-1,2,3,4-tetrahydro-naphthalin-2-carbonsaeure
- AC1L5ZC9
- AC1Q5UP6
- AG-J-53199
- AR-1F8283
- CTK0I2244
- NSC138960
- NSC-138960
- 14557-88-1
- DTXSID10300780
-
- Inchi: 1S/C14H18O2/c1-8-4-5-9(2)13-10(3)6-11(14(15)16)7-12(8)13/h4-5,10-11H,6-7H2,1-3H3,(H,15,16)
- InChI Key: BXLWMFTXONCQMK-UHFFFAOYSA-N
- SMILES: OC(C1CC2C(C)=CC=C(C)C=2C(C)C1)=O
Computed Properties
- Exact Mass: 218.13074
- Monoisotopic Mass: 218.130679813g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 274
- 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
- XLogP3: 3.2
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.3
- LogP: 3.05390
2-Naphthalenecarboxylicacid, 1,2,3,4-tetrahydro-4,5,8-trimethyl- Related Literature
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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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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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