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115117-86-7

115117-86-7 | 2-Propen-1-ol, 3-(2-naphthalenyl)-, 1-acetate, (2E)-

CAS No: 115117-86-7 Catalog No: AG000GBP MDL No:

Product Description

Catalog Number:
AG000GBP
Chemical Name:
2-Propen-1-ol, 3-(2-naphthalenyl)-, 1-acetate, (2E)-
CAS Number:
115117-86-7
Molecular Formula:
C15H14O2
Molecular Weight:
226.2705
IUPAC Name:
acetic acid;3-naphthalen-2-ylprop-2-en-1-ol
InChI:
InChI=1S/C13H12O.C2H4O2/c14-9-3-4-11-7-8-12-5-1-2-6-13(12)10-11;1-2(3)4/h1-8,10,14H,9H2;1H3,(H,3,4)
InChI Key:
LGMKPHNAKMFRTC-UHFFFAOYSA-N
SMILES:
CC(=O)OC/C=C/c1ccc2c(c1)cccc2

Properties

Complexity:
228  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.11g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
244.29g/mol
Monoisotopic Mass:
244.11g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  

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