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122750-56-5

122750-56-5 | Benzeneacetic acid, 2-(dimethoxymethyl)-, methyl ester

CAS No: 122750-56-5 Catalog No: AG000JA7 MDL No:

Product Description

Catalog Number:
AG000JA7
Chemical Name:
Benzeneacetic acid, 2-(dimethoxymethyl)-, methyl ester
CAS Number:
122750-56-5
Molecular Formula:
C12H16O4
Molecular Weight:
224.2530
IUPAC Name:
methyl 2-[2-(dimethoxymethyl)phenyl]acetate
InChI:
InChI=1S/C12H16O4/c1-14-11(13)8-9-6-4-5-7-10(9)12(15-2)16-3/h4-7,12H,8H2,1-3H3
InChI Key:
NDJZSZKLBFLCGY-UHFFFAOYSA-N
SMILES:
COC(=O)Cc1ccccc1C(OC)OC

Properties

Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.105g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.256g/mol
Monoisotopic Mass:
224.105g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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