Benzoic acid, 2-hydroxy-, (3Z)-3-hexenyl ester


Chemical Name: Benzoic acid, 2-hydroxy-, (3Z)-3-hexenyl ester
CAS Number: 65405-77-8
Product Number: AG003U6R(AGN-PC-0OF8I4)
Synonyms:
MDL No:
Molecular Formula: C13H16O3
Molecular Weight: 220.2643

Identification/Properties


Properties
Storage:
2-8℃;Keep in dry area;
Form:
Liquid
Computed Properties
Molecular Weight:
220.268g/mol
XLogP3:
4.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
6
Exact Mass:
220.11g/mol
Monoisotopic Mass:
220.11g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
235
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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