Cas no 28749-24-8 (Hexanoic acid,1-naphthalenyl ester)
28749-24-8 structure
Product Name:Hexanoic acid,1-naphthalenyl ester
CAS No:28749-24-8
MF:C16H18O2
MW:242.312924861908
CID:239897
PubChem ID:588895
Update Time:2025-04-19
Hexanoic acid,1-naphthalenyl ester Chemical and Physical Properties
Names and Identifiers
-
- Hexanoic acid,1-naphthalenyl ester
- naphthalen-1-yl hexanoate
- naphthyl hexanoate
- naphthylcaproate
- Hexanoic acid, 1-naphthyl ester
- DTXSID00343303
- AO-548/41204166
- SCHEMBL7086844
- 1-Naphthyl hexanoate #
- 28749-24-8
- 1-Naphthyl hexanoate
-
- Inchi： 1S/C16H18O2/c1-2-3-4-12-16(17)18-15-11-7-9-13-8-5-6-10-14(13)15/h5-11H,2-4,12H2,1H3
- InChI Key： KTEVDMGPKQVXDF-UHFFFAOYSA-N
- SMILES： O(C1C=CC=C2C=CC=CC=12)C(CCCCC)=O
Computed Properties
- Exact Mass: 242.13074
- Monoisotopic Mass: 242.130679813g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 6
- Complexity: 262
- 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: 4.7
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 1.066
- Boiling Point: 366.4°C at 760 mmHg
- Flash Point: 123.9°C
- Refractive Index: 1.564
- PSA: 26.3
Hexanoic acid,1-naphthalenyl ester Related Literature
-
Arantxa Rodríguez,David D. Miller,Richard F. W. Jackson Org. Biomol. Chem. 2003 1 973
28749-24-8 (Hexanoic acid,1-naphthalenyl ester) Related Products
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