Cas no 2876-69-9 (2-naphthaleneacetic acid, propyl ester)
2876-69-9 structure
Product Name:2-naphthaleneacetic acid, propyl ester
CAS No:2876-69-9
MF:C15H16O2
MW:228.286344528198
CID:1436820
PubChem ID:13331677
Update Time:2025-04-20
2-naphthaleneacetic acid, propyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-naphthaleneacetic acid, propyl ester
- Propyl 2-naphthylacetate
- LogP
- propyl 2-naphthalen-2-ylacetate
- Propyl (naphthalen-2-yl)acetate
- DTXSID40537148
- SCHEMBL10810921
- 2876-69-9
- AKOS005832925
- naphthalene-2-acetic acid propyl ester
-
- Inchi： 1S/C15H16O2/c1-2-9-17-15(16)11-12-7-8-13-5-3-4-6-14(13)10-12/h3-8,10H,2,9,11H2,1H3
- InChI Key： QXZFVUNAGXVEGK-UHFFFAOYSA-N
- SMILES： O(CCC)C(CC1C=CC2C=CC=CC=2C=1)=O
Computed Properties
- Exact Mass: 228.11508
- Monoisotopic Mass: 228.115029749g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 5
- Complexity: 249
- 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: 4
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
2-naphthaleneacetic acid, propyl ester Related Literature
-
Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
-
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
-
Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
2876-69-9 (2-naphthaleneacetic acid, propyl ester) Related Products
- 2876-78-0(methyl 2-(naphthalen-1-yl)acetate)
- 4606-15-9(Benzeneacetic acid,propyl ester)
- 122-70-3(2-Phenylethyl propionate)
- 14062-19-2(Ethyl p-Tolylacetate)
- 105337-18-6(Ethyl 2-(3,5-dimethylphenyl)acetate)
- 101-97-3(Ethyl phenylacetate)
- 36076-26-3(1,4-Phenylenediacetic Acid Diethyl Ester)
- 40061-55-0(Ethyl m-tolylacetate)
- 2122-70-5(1-Naphthaleneacetic Acid Ethyl Ester)
- 102-20-5(2-Phenylethyl 2-Phenylacetate)
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