Benzeneacetic acid, a-methoxy-, (aR)-


Chemical Name: Benzeneacetic acid, a-methoxy-, (aR)-
CAS Number: 3966-32-3
Product Number: AG003C3B(AGN-PC-0RKE1C)
Synonyms:
MDL No:
Molecular Formula: C9H10O3
Molecular Weight: 166.1739

Identification/Properties


Properties
MP:
66-68 °C(lit.)
BP:
283.8 °C at 760 mmHg
Storage:
Room Temperature;
Form:
Solid
Refractive Index:
-147 ° (C=0.5, EtOH)
Computed Properties
Molecular Weight:
166.176g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
166.063g/mol
Monoisotopic Mass:
166.063g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
150
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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