Home Other Building Blocks ETHYL MESITYLACETATE

ETHYL MESITYLACETATE

CAS No.:
5460-08-2
Catalog Number:
AG003QFP
Molecular Formula:
C13H18O2
Molecular Weight:
206.2808
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Product Description
Catalog Number:
AG003QFP
Chemical Name:
ETHYL MESITYLACETATE
CAS Number:
5460-08-2
Molecular Formula:
C13H18O2
Molecular Weight:
206.2808
MDL Number:
MFCD00051916
IUPAC Name:
ethyl 2-(2,4,6-trimethylphenyl)acetate
InChI:
InChI=1S/C13H18O2/c1-5-15-13(14)8-12-10(3)6-9(2)7-11(12)4/h6-7H,5,8H2,1-4H3
InChI Key:
OFZZPFNYAMIBNU-UHFFFAOYSA-N
SMILES:
CCOC(=O)Cc1c(C)cc(cc1C)C
NSC Number:
8350
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.131g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.285g/mol
Monoisotopic Mass:
206.131g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties