Cas no 3021-73-6 (4a(2H)-Naphthalenecarboxylicacid, octahydro-, cis-)
3021-73-6 structure
Product Name:4a(2H)-Naphthalenecarboxylicacid, octahydro-, cis-
4a(2H)-Naphthalenecarboxylicacid, octahydro-, cis- Chemical and Physical Properties
Names and Identifiers
-
- 4a(2H)-Naphthalenecarboxylicacid, octahydro-, cis-
- cis-Decalin-9-Carboxylic acid
- Octahydro-4a(2H)-naphthalenecarboxylic acid, cis-
- 2543-75-1
- decalin-9-carboxylic acid
- 7112-20-1
- 4a(2H)-Naphthalenecarboxylic acid, octahydro-, trans-
- SCHEMBL1682648
- trans-Decalin-9-carboxylic acid
- cis-9-Carboxydecalin
- Octahydro-4a(2H)-naphthalenecarboxylic acid
- Octahydro-4a(2H)-naphthalenecarboxylic acid #
- NSC-643018
- octahydro-naphthalene-4a-carboxylic acid
- NCI60_014567
- EN300-7465258
- decahydronaphthalene-4a-carboxylic acid
- CHEMBL2005629
- Octahydronaphthalene-4a(2H)-carboxylic acid
- 2,3,4,5,6,7,8,8a-octahydro-1H-naphthalene-4a-carboxylic acid
- DTXSID90948285
- 4a(2H)-Naphthalenecarboxylic acid, octahydro-, cis-
- NSC643018
- decalin-4a-carboxylic acid
- 3021-73-6
- 4a(2H)-Naphthalenecarboxylic acid, octahydro-
- CIS-OCTAHYDRO-4A(2H)-NAPHTHALENECARBOXYLIC ACID
-
- Inchi： 1S/C11H18O2/c12-10(13)11-7-3-1-5-9(11)6-2-4-8-11/h9H,1-8H2,(H,12,13)
- InChI Key： VAMBVWHKUJPMEB-UHFFFAOYSA-N
- SMILES： OC(C12CCCCC1CCCC2)=O
Computed Properties
- Exact Mass: 182.13074
- Monoisotopic Mass: 182.130679813g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 198
- 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: 3.3
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.3
4a(2H)-Naphthalenecarboxylicacid, octahydro-, cis- Related Literature
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
-
M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
-
Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
-
P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
3021-73-6 (4a(2H)-Naphthalenecarboxylicacid, octahydro-, cis-) Related Products
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