Home Other Building Blocks ethyl 2-methyl-3-(2-methylphenyl)propanoate

ethyl 2-methyl-3-(2-methylphenyl)propanoate

CAS No.:
120958-27-2
Catalog Number:
AG01BUX7
Molecular Formula:
C13H18O2
Molecular Weight:
206.2808
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Product Description
Catalog Number:
AG01BUX7
Chemical Name:
ethyl 2-methyl-3-(2-methylphenyl)propanoate
CAS Number:
120958-27-2
Molecular Formula:
C13H18O2
Molecular Weight:
206.2808
MDL Number:
MFCD30295388
IUPAC Name:
ethyl 2-methyl-3-(2-methylphenyl)propanoate
InChI:
InChI=1S/C13H18O2/c1-4-15-13(14)11(3)9-12-8-6-5-7-10(12)2/h5-8,11H,4,9H2,1-3H3
InChI Key:
VAYZZMQSAPAGNY-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(Cc1ccccc1C)C
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:
5  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties