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142808-38-6 | Apiodionene
CAS No: 142808-38-6 Catalog No: AG00A0DD MDL No:
Product Description
Catalog Number:
AG00A0DD
Chemical Name:
Apiodionene
CAS Number:
142808-38-6
IUPAC Name:
(3E)-3-[(2R,3R)-3-methyl-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-ylidene]pyrrolidine-2,4-dione
InChI:
InChI=1S/C13H15NO3/c1-3-4-10-8(2)5-6-11(17-10)12-9(15)7-14-13(12)16/h3-6,8,10H,7H2,1-2H3,(H,14,16)/b4-3+,12-11+/t8-,10-/m1/s1
InChI Key:
POOATOCXPUJODS-XLIZWXFJSA-N
Properties
Complexity:
446
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
2
Exact Mass:
233.105g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.267g/mol
Monoisotopic Mass:
233.105g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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