1(3H)-Isobenzofuranone, 5-amino-


Chemical Name: 1(3H)-Isobenzofuranone, 5-amino-
CAS Number: 65399-05-5
Product Number: AG00E8UG(AGN-PC-0JVFKD)
Synonyms:
MDL No: MFCD00778315
Molecular Formula: C8H7NO2
Molecular Weight: 149.1467

Identification/Properties


Computed Properties
Molecular Weight:
149.149g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
149.048g/mol
Monoisotopic Mass:
149.048g/mol
Topological Polar Surface Area:
52.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
181
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

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NMR Spectrum


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