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Home > Nitro Compounds > 26074-65-7
26074-65-7 | Hexanoic acid, 2-(hydroxyimino)-6-nitro-, ethyl ester
CAS No: 26074-65-7 Catalog No: AG002RKX MDL No:
Product Description
Catalog Number:
AG002RKX
Chemical Name:
Hexanoic acid, 2-(hydroxyimino)-6-nitro-, ethyl ester
CAS Number:
26074-65-7
Molecular Formula:
C8H14N2O5
Molecular Weight:
218.2072
IUPAC Name:
ethyl 2-hydroxyimino-6-nitrohexanoate
InChI:
InChI=1S/C8H14N2O5/c1-2-15-8(11)7(9-12)5-3-4-6-10(13)14/h12H,2-6H2,1H3
InChI Key:
LZAJCPTUSAKXPO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)CCCCC(=NO)C(=O)OCC
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.209g/mol
Monoisotopic Mass:
218.09g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.6
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