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Home > Indoles and Oxindole > 68260-70-8
68260-70-8 | 2-prop-2-enyl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CAS No: 68260-70-8 Catalog No: AG006CYG MDL No:
Product Description
Catalog Number:
AG006CYG
Chemical Name:
2-prop-2-enyl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CAS Number:
68260-70-8
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
IUPAC Name:
2-prop-2-enyl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
InChI:
InChI=1S/C11H15NO2/c1-2-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h2,8-9H,1,3-7H2
InChI Key:
HOADZLUEDQUBQV-UHFFFAOYSA-N
SMILES:
C=CCN1C(=O)C2C(C1=O)CCCC2
NSC Number:
19694
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.11g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.246g/mol
Monoisotopic Mass:
193.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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