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2150-42-7 | Methyl 2,3-dimethoxybenzoate
CAS No: 2150-42-7 Catalog No: AG003RLL MDL No:MFCD00027555
Product Description
Catalog Number:
AG003RLL
Chemical Name:
Methyl 2,3-dimethoxybenzoate
CAS Number:
2150-42-7
Molecular Formula:
C10H12O4
Molecular Weight:
196.1999
MDL Number:
MFCD00027555
IUPAC Name:
methyl 2,3-dimethoxybenzoate
InChI:
InChI=1S/C10H12O4/c1-12-8-6-4-5-7(9(8)13-2)10(11)14-3/h4-6H,1-3H3
InChI Key:
MGLIMPUPAKQITQ-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1OC)OC
EC Number:
218-425-7
NSC Number:
146462
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.202g/mol
Monoisotopic Mass:
196.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| 2-Aryl-1,4-naphthoquinone-1-oxime methyl ethers: their cytotoxic activity. | Chemical & pharmaceutical bulletin 20110101 |
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