Home Other Building Blocks methyl 2-(4-fluoro-2-methylphenyl)-2-propoxyacetate

methyl 2-(4-fluoro-2-methylphenyl)-2-propoxyacetate

CAS No.:
2138352-04-0
Catalog Number:
AG01EIRK
Molecular Formula:
C13H17FO3
Molecular Weight:
240.2707
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Product Description
Catalog Number:
AG01EIRK
Chemical Name:
methyl 2-(4-fluoro-2-methylphenyl)-2-propoxyacetate
CAS Number:
2138352-04-0
Molecular Formula:
C13H17FO3
Molecular Weight:
240.2707
MDL Number:
MFCD31446527
IUPAC Name:
methyl 2-(4-fluoro-2-methylphenyl)-2-propoxyacetate
InChI:
InChI=1S/C13H17FO3/c1-4-7-17-12(13(15)16-3)11-6-5-10(14)8-9(11)2/h5-6,8,12H,4,7H2,1-3H3
InChI Key:
ITNVKTOSLYOCJR-UHFFFAOYSA-N
SMILES:
CCCOC(c1ccc(cc1C)F)C(=O)OC
Properties
Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.116g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.274g/mol
Monoisotopic Mass:
240.116g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties