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N-Hydroxyoctanamide

CAT: 0127-OR1014397-02Size: 500 gDry Ice: NoHazardous: No
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CAT#:0127-OR1014397-02Size:500 g
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CAS Number
7377-03-9
MDL Number
MFCD00143918
Purity
98%
Smiles
CCCCCCCC(=O)NO

Chemical Information

Octanohydroxamic acid

used as ruminal urease inhibitor; structure; RN given refers to unlabeled parent cpd

CAS Number7377-03-9
PubChem CID23846
IUPAC NameN-hydroxyoctanamide
Molecular FormulaC8H17NO2
Molecular Weight159.23
XLogP1.3
Topological Polar Surface Area49.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Heavy Atom Count11
Formal Charge0
Complexity104
SMILES
CCCCCCCC(=O)NO
InChI
InChI=1S/C8H17NO2/c1-2-3-4-5-6-7-8(10)9-11/h11H,2-7H2,1H3,(H,9,10)
InChIKey
RGUVUPQQFXCJFC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Octanohydroxamic acid
CAS: 7377-03-9
CID: 23846
Formula: C8H17NO2
MW: 159.23
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight159.23
XLogP31.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass159.125928785
Monoisotopic Mass159.125928785
Topological Polar Surface Area49.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity104
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes