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24762-04-7 | Butanoic acid, 2-diazo-3-oxo-, methyl ester
CAS No: 24762-04-7 Catalog No: AG002PDJ MDL No:
Product Description
Catalog Number:
AG002PDJ
Chemical Name:
Butanoic acid, 2-diazo-3-oxo-, methyl ester
CAS Number:
24762-04-7
Molecular Formula:
C5H6N2O3
Molecular Weight:
142.1127
IUPAC Name:
methyl 2-diazo-3-oxobutanoate
InChI:
InChI=1S/C5H6N2O3/c1-3(8)4(7-6)5(9)10-2/h1-2H3
InChI Key:
ZBCRHIQRNYDVMB-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=C(C(=O)OC)C(=O)C
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.038g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.114g/mol
Monoisotopic Mass:
142.038g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
45.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.2
Literature
| Title | Journal |
|---|---|
| Total synthesis of siphonazole and its O-methyl derivative, structurally unusual bis-oxazole natural products. | Organic & biomolecular chemistry 20081107 |
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