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2033-88-7 | Phenol, 3,4-dimethoxy-, 1-formate
CAS No: 2033-88-7 Catalog No: AG0028SP MDL No:
Product Description
Catalog Number:
AG0028SP
Chemical Name:
Phenol, 3,4-dimethoxy-, 1-formate
CAS Number:
2033-88-7
Molecular Formula:
C9H10O4
Molecular Weight:
182.1733
IUPAC Name:
(3,4-dimethoxyphenyl) formate
InChI:
InChI=1S/C9H10O4/c1-11-8-4-3-7(13-6-10)5-9(8)12-2/h3-6H,1-2H3
InChI Key:
AFELMBLPQGNDIS-UHFFFAOYSA-N
SMILES:
O=COc1ccc(c(c1)OC)OC
NSC Number:
141519
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.058g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.175g/mol
Monoisotopic Mass:
182.058g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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