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Home > Nitro Compounds > 87497-88-9
87497-88-9 | 2-Propenoic acid, 2-nitroso-, ethyl ester
CAS No: 87497-88-9 Catalog No: AG004DRQ MDL No:
Product Description
Catalog Number:
AG004DRQ
Chemical Name:
2-Propenoic acid, 2-nitroso-, ethyl ester
CAS Number:
87497-88-9
Molecular Formula:
C5H7NO3
Molecular Weight:
129.1140
IUPAC Name:
ethyl 2-nitrosoprop-2-enoate
InChI:
InChI=1S/C5H7NO3/c1-3-9-5(7)4(2)6-8/h2-3H2,1H3
InChI Key:
NEQKBXPSPQJCQF-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=C)N=O
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.043g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
129.115g/mol
Monoisotopic Mass:
129.043g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Literature
| Title | Journal |
|---|---|
| Synthesis of a protected trihydroxyindolizidine 3-carboxylate via a hetero-Diels-Alder addition of ethyl 2-nitrosoacrylate to a D-ribose-derived exo-glycal. | Carbohydrate research 20110301 |
| Synthesis of C-glycosylated amino acids by hetero-Diels-Alder addition of ethyl 2-nitrosoacrylate to exo-glycals. | Carbohydrate research 20110201 |
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