methyl (S)-3-cyclopropyl-3-(3-hydroxyphenyl)propanoate


Chemical Name: methyl (S)-3-cyclopropyl-3-(3-hydroxyphenyl)propanoate
CAS Number: 1142223-08-2
Product Number: AG000AV4(AGN-PC-0WAJJ5)
Synonyms:
MDL No:
Molecular Formula: C13H16O3
Molecular Weight: 220.2643

Identification/Properties


Computed Properties
Molecular Weight:
220.268g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
220.11g/mol
Monoisotopic Mass:
220.11g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
248
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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