1H-Isoindole, 2,3-dihydro-5-methoxy-2-(phenylmethyl)-


Chemical Name: 1H-Isoindole, 2,3-dihydro-5-methoxy-2-(phenylmethyl)-
CAS Number: 127168-89-2
Product Number: AG000WQ8(AGN-PC-0041IJ)
Synonyms:
MDL No:
Molecular Formula: C16H17NO
Molecular Weight: 239.3123

Identification/Properties


Computed Properties
Molecular Weight:
239.318g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
239.131g/mol
Monoisotopic Mass:
239.131g/mol
Topological Polar Surface Area:
12.5A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
262
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:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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