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859775-82-9 | ETHYL 2-METHOXY-5-METHYLBENZOYLFORMATE
CAS No: 859775-82-9 Catalog No: AG004QBF MDL No:MFCD09801429
Product Description
Catalog Number:
AG004QBF
Chemical Name:
ETHYL 2-METHOXY-5-METHYLBENZOYLFORMATE
CAS Number:
859775-82-9
Molecular Formula:
C12H14O4
Molecular Weight:
222.2372
MDL Number:
MFCD09801429
IUPAC Name:
ethyl 2-(2-methoxy-5-methylphenyl)-2-oxoacetate
InChI:
InChI=1S/C12H14O4/c1-4-16-12(14)11(13)9-7-8(2)5-6-10(9)15-3/h5-7H,4H2,1-3H3
InChI Key:
STYOUXSMZIJPGG-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=O)c1cc(C)ccc1OC
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.089g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.24g/mol
Monoisotopic Mass:
222.089g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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