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Home > Indoles and Oxindole > 2436-29-5
2436-29-5 | 3-(1,3-Dioxoisoindolin-2-yl)propanal
CAS No: 2436-29-5 Catalog No: AG007NN4 MDL No:MFCD01704466
Product Description
Catalog Number:
AG007NN4
Chemical Name:
3-(1,3-Dioxoisoindolin-2-yl)propanal
CAS Number:
2436-29-5
Molecular Formula:
C11H9NO3
Molecular Weight:
203.1941
MDL Number:
MFCD01704466
IUPAC Name:
3-(1,3-dioxoisoindol-2-yl)propanal
InChI:
InChI=1S/C11H9NO3/c13-7-3-6-12-10(14)8-4-1-2-5-9(8)11(12)15/h1-2,4-5,7H,3,6H2
InChI Key:
IBSDSIHTMABATG-UHFFFAOYSA-N
SMILES:
O=CCCN1C(=O)c2c(C1=O)cccc2
EC Number:
700-133-0
NSC Number:
166600
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.058g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.197g/mol
Monoisotopic Mass:
203.058g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Literature
| Title | Journal |
|---|---|
| Asymmetric synthesis of bicyclic piperidines via L-proline catalyzed aldol reaction of 3-phthalimidopropanal. | Chirality 20080601 |
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