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Home > Nitro Compounds > 88055-19-0
88055-19-0 | Decanoic acid, 2-(nitrooxy)-
CAS No: 88055-19-0 Catalog No: AG004FGO MDL No:
Product Description
Catalog Number:
AG004FGO
Chemical Name:
Decanoic acid, 2-(nitrooxy)-
CAS Number:
88055-19-0
Molecular Formula:
C10H19NO5
Molecular Weight:
233.2616
IUPAC Name:
2-nitrooxydecanoic acid
InChI:
InChI=1S/C10H19NO5/c1-2-3-4-5-6-7-8-9(10(12)13)16-11(14)15/h9H,2-8H2,1H3,(H,12,13)
InChI Key:
BHWLLBWBFLIDAS-UHFFFAOYSA-N
SMILES:
CCCCCCCCC(C(=O)O)O[N+](=O)[O-]
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.126g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.264g/mol
Monoisotopic Mass:
233.126g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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