Benzoic acid, 3-[2-(1,1-dimethylethoxy)-2-oxoethoxy]-


Chemical Name: Benzoic acid, 3-[2-(1,1-dimethylethoxy)-2-oxoethoxy]-
CAS Number: 313709-63-6
Product Number: AG00CM6M(AGN-PC-008MNZ)
Synonyms:
MDL No:
Molecular Formula: C13H16O5
Molecular Weight: 252.2631

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
252.266g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
6
Exact Mass:
252.1g/mol
Monoisotopic Mass:
252.1g/mol
Topological Polar Surface Area:
72.8A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
305
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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