Home Other Building Blocks Ethyl 2-(3,5-dimethylphenyl)acetate

Ethyl 2-(3,5-dimethylphenyl)acetate

CAS No.:
105337-18-6
Catalog Number:
AG003Q6S
Molecular Formula:
C12H16O2
Molecular Weight:
192.2542
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Product Description
Catalog Number:
AG003Q6S
Chemical Name:
Ethyl 2-(3,5-dimethylphenyl)acetate
CAS Number:
105337-18-6
Molecular Formula:
C12H16O2
Molecular Weight:
192.2542
MDL Number:
MFCD00082645
IUPAC Name:
ethyl 2-(3,5-dimethylphenyl)acetate
InChI:
InChI=1S/C12H16O2/c1-4-14-12(13)8-11-6-9(2)5-10(3)7-11/h5-7H,4,8H2,1-3H3
InChI Key:
ZGLFZLKBBSUQPS-UHFFFAOYSA-N
SMILES:
CCOC(=O)Cc1cc(C)cc(c1)C
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.115g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.258g/mol
Monoisotopic Mass:
192.115g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties