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1464-96-6 | Benzoic acid, 2,6-dimethoxy-, ethyl ester
CAS No: 1464-96-6 Catalog No: AG001DZ0 MDL No:MFCD00075808
Product Description
Catalog Number:
AG001DZ0
Chemical Name:
Benzoic acid, 2,6-dimethoxy-, ethyl ester
CAS Number:
1464-96-6
Molecular Formula:
C11H14O4
Molecular Weight:
210.2265
MDL Number:
MFCD00075808
IUPAC Name:
ethyl 2,6-dimethoxybenzoate
InChI:
InChI=1S/C11H14O4/c1-4-15-11(12)10-8(13-2)6-5-7-9(10)14-3/h5-7H,4H2,1-3H3
InChI Key:
WWIQFGKXLFJMKM-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(OC)cccc1OC
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.089g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.229g/mol
Monoisotopic Mass:
210.089g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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