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Home > Nitro Compounds > 943-37-3
943-37-3 | ETHYL 5-NITRO-2-FUROATE
CAS No: 943-37-3 Catalog No: AG003QCW MDL No:MFCD00092566
Product Description
Catalog Number:
AG003QCW
Chemical Name:
ETHYL 5-NITRO-2-FUROATE
CAS Number:
943-37-3
Molecular Formula:
C7H7NO5
Molecular Weight:
185.1342
MDL Number:
MFCD00092566
IUPAC Name:
ethyl 5-nitrofuran-2-carboxylate
InChI:
InChI=1S/C7H7NO5/c1-2-12-7(9)5-3-4-6(13-5)8(10)11/h3-4H,2H2,1H3
InChI Key:
JMNXLAQKIHVFIC-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(o1)C(=O)OCC
EC Number:
213-400-7
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.032g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.135g/mol
Monoisotopic Mass:
185.032g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
85.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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