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Home > Indoles and Oxindole > 2007916-73-4
2007916-73-4 | 1H-Isoindol-1-one, 2,3,4,7-tetrahydro-
CAS No: 2007916-73-4 Catalog No: AG002CYL MDL No:
Product Description
Catalog Number:
AG002CYL
Chemical Name:
1H-Isoindol-1-one, 2,3,4,7-tetrahydro-
CAS Number:
2007916-73-4
Molecular Formula:
C8H9NO
Molecular Weight:
135.1632
IUPAC Name:
2,3,4,7-tetrahydroisoindol-1-one
InChI:
InChI=1S/C8H9NO/c10-8-7-4-2-1-3-6(7)5-9-8/h1-2H,3-5H2,(H,9,10)
InChI Key:
CFUSPEYXMLMVEE-UHFFFAOYSA-N
SMILES:
O=C1NCC2=C1CC=CC2
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.068g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
135.166g/mol
Monoisotopic Mass:
135.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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