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Home > Indoles and Oxindole > 95268-27-2
95268-27-2 | 1H-Isoindole-1,3(2H)-dione, 2-(pentenyl)-
CAS No: 95268-27-2 Catalog No: AG0065OL MDL No:
Product Description
Catalog Number:
AG0065OL
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-(pentenyl)-
CAS Number:
95268-27-2
Molecular Formula:
C13H13NO2
Molecular Weight:
215.2478
IUPAC Name:
2-pent-1-enylisoindole-1,3-dione
InChI:
InChI=1S/C13H13NO2/c1-2-3-6-9-14-12(15)10-7-4-5-8-11(10)13(14)16/h4-9H,2-3H2,1H3
InChI Key:
SLOFANMNMOSQEJ-UHFFFAOYSA-N
SMILES:
CCCC=CN1C(=O)c2c(C1=O)cccc2
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.252g/mol
Monoisotopic Mass:
215.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3
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