Home Carbonyls 4-Methoxycarbonylmethyl-benzoic acid methyl ester

4-Methoxycarbonylmethyl-benzoic acid methyl ester

CAS No.:
52787-14-1
Catalog Number:
AG0038O7
Molecular Formula:
C11H12O4
Molecular Weight:
208.2106
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$25
- +
25g
98%
In Stock USA
United States
$88
- +
100g
98%
In Stock USA
United States
$263
- +
500g
98%
In Stock USA
United States
$1100
- +
Product Description
Catalog Number:
AG0038O7
Chemical Name:
4-Methoxycarbonylmethyl-benzoic acid methyl ester
CAS Number:
52787-14-1
Molecular Formula:
C11H12O4
Molecular Weight:
208.2106
MDL Number:
MFCD07779210
IUPAC Name:
methyl 4-(2-methoxy-2-oxoethyl)benzoate
InChI:
InChI=1S/C11H12O4/c1-14-10(12)7-8-3-5-9(6-4-8)11(13)15-2/h3-6H,7H2,1-2H3
InChI Key:
QAQYBHOZQQRJBA-UHFFFAOYSA-N
SMILES:
COC(=O)Cc1ccc(cc1)C(=O)OC
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.074g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.213g/mol
Monoisotopic Mass:
208.074g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties