Cas no 14233-72-8 (Propanenitrile, 3-(2-naphthalenyloxy)-)
14233-72-8 structure
Product Name:Propanenitrile, 3-(2-naphthalenyloxy)-
CAS No:14233-72-8
MF:C13H11NO
MW:197.232543230057
CID:1310946
PubChem ID:2801397
Update Time:2025-04-20
Propanenitrile, 3-(2-naphthalenyloxy)- Chemical and Physical Properties
Names and Identifiers
-
- Propanenitrile, 3-(2-naphthalenyloxy)-
- 3-naphthalen-2-yloxypropanenitrile
- Maybridge1_002257
- AKOS000185631
- 14233-72-8
- DTXSID50384241
- SCHEMBL11634195
- HMS547O13
-
- Inchi： 1S/C13H11NO/c14-8-3-9-15-13-7-6-11-4-1-2-5-12(11)10-13/h1-2,4-7,10H,3,9H2
- InChI Key： HDOAQRQSTGWBTP-UHFFFAOYSA-N
- SMILES： O(CCC#N)C1C=CC2C=CC=CC=2C=1
Computed Properties
- Exact Mass: 197.08413
- Monoisotopic Mass: 197.084063974g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 242
- 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: 3.2
- Topological Polar Surface Area: 33?2
Experimental Properties
- PSA: 33.02
Propanenitrile, 3-(2-naphthalenyloxy)- Related Literature
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
-
Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
-
J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
14233-72-8 (Propanenitrile, 3-(2-naphthalenyloxy)-) Related Products
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- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
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