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Home> Encyclopedia > Hot Product Listed 9   > 9-Octadecenamide,N-(2-hydroxyethyl)-, (9Z)-
111-58-0 structure

9-Octadecenamide,N-(2-hydroxyethyl)-, (9Z)-

Iupac Name:(Z)-N-(2-hydroxyethyl)octadec-9-enamide
CAS No.:111-58-0
EINECS(EC#): 203-884-8
Molecular Weight:325.537
Molecular Formula:C20H39NO2 (isomer)
Names and Identifiers
Synonyms

(9z)-n-(2-hydroxyethyl)-9-octadecenamide (z)-n-(2-hydroxyethyl)-9-octadecenamide 1HI5J9N8E6 9-octadecenamide, n-(2-hydroxyethyl)- 9-octadecenamide, n-(2-hydroxyethyl)-, (9z)- 9-octadecenamide, n-(2-hydroxyethyl)-, (z)- 9-Octadecenamide,N-(2-hydroxyethyl)-, (Z)- A802386 AB1005568 ak116336 AM3101 AS-15152 AX8017536 bdbm29080 BOWVQLFMWHZBEF-KTKRTIGZSA-N bs0139 C20792 CCG-205023 chebi:71466 chembl280065 D07MBC DTXSID1044516 einecs 203-884-8 EU-0100942 HMS2233E21 HMS3262N06 HMS3649J05 J10351 LMFA08040015 LOPAC0_000942 lopac-o-0383 LS-97729 mfcd00045972 MLS002153155 MOLPORT-003-959-060 monoethanolamine oleic acid amide n-(2-hydroxyethyl)-9-octadecenamide n-(2-hydroxyethyl)-9z-octadecenamide n-(2-hydroxyethyl)octadec-9-enamide n-(2-hydroxyethyl)oleamide n-(9z-octadecenoyl)-ethanolamine n-(cis-9-octadecenoyl) ethanolamine n-(cis-9-octadecenoyl)ethanolamine n-(hydroxyethyl) oleamide n-(hydroxyethyl)oleamide n-2-hydroxyethyl-9(z)-octadecenamide NCGC00015761-01 NCGC00015761-02 NCGC00015761-03 NCGC00015761-04 NCGC00015761-05 NCGC00015761-06 NCGC00015761-07 NCGC00025182-01 NCGC00025182-02 NCGC00025182-04 NCGC00025182-05 NCGC00025182-06 NCGC00261627-01 n-oea n-oleoyl ethanolamide n-oleoyl ethanolamine N-Oleoyl-2-aminoethanol n-oleoylethanolamine n-oleoylethanolamine, ~98% (tlc) O 0383 oea, oleoylethanolamide oleamide mea Oleamide, N-(2-hydroxyethyl)- (6CI,7CI,8CI) oleic acid ethanolamide Oleic acidmonoethanolamide oleic monoethanolamide oleoyl ethanolamide oleoyl monoethanolamide oleoylethanolamide oleoylethanolamide (oea) oleylethanolamide SCHEMBL177713 smr001230650 SPECTRUM5_002037 sr-01000076041 SR-01000076041-8 ST24048305 ST51052823 tocris-1484 tox21_500942 W-109412 ZINC8034993

Inchi
InChI=1S/C20H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)21-18-19-22/h9-10,22H,2-8,11-19H2,1H3,(H,21,23)/b10-9-
InChkey
BOWVQLFMWHZBEF-KTKRTIGZSA-N
Canonical Smiles
CCCCCCCCC=CCCCCCCCC(=O)NCCO
Isomers Smiles
CCCCCCCC/C=C\CCCCCCCC(=O)NCCO
Properties
Appearance
white to off-white solid
Density
0.915
Melting Point
50-60ºC
Boiling Point
496.4 °C at 760 mmHg
Vapour
6.22E-12mmHg at 25°C
Refractive Index
1.473
Flash Point
254 °C
Solubility
Soluble in DMSO (>25 mg/ml) and ethanol (>25 mg/ml)
Other physical and chemical properties
OtherSolid
Storage temp
−20°C
Safety and Handling
Hazard Codes
Xi
Risk Statements
R36/37/38
Safety Statements
S26;S36
Safety

Safety Information of N-(2-Hydroxyethyl)-9-octadecenamide (CAS NO.111-58-0):
Hazard Codes: XiIrritant
Risk Statements: 36/37/38 
36:  Irritating to the eyes 
37:  Irritating to the respiratory system 
38:  Irritating to the skin 
Safety Statements: 26-36
26:  In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 
36:  Wear suitable protective clothing 
WGK Germany: 2

Specification

 N-(2-Hydroxyethyl)-9-octadecenamide , its CAS NO. is 111-58-0, the synonyms are 9-Octadecenamide, N-(2-hydroxyethyl)- ; Monoethanolamine oleic acid amide ; N-(2-Hydroxyethyl)oleamide ; N-Oleoylethanolamine ; Oleamide MEA ; Oleoyl monoethanolamide .

MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Skin irritation, Category 2

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H315 Causes skin irritation

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

P280 Wear protective gloves/protective clothing/eye protection/face protection.

Response

P302+P352 IF ON SKIN: Wash with plenty of water/...

P321 Specific treatment (see ... on this label).

P332+P313 If skin irritation occurs: Get medical advice/attention.

P362+P364 Take off contaminated clothing and wash it before reuse.

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:325.537g/mol
  • Molecular Formula:C20H39NO2
  • Compound Is Canonicalized:True
  • Exact Mass:325.298
  • Monoisotopic Mass:325.298
  • Complexity:277
  • Rotatable Bond Count:17
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:49.3A^2
  • Heavy Atom Count:23
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:1
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADcfB6MAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHgAQCAAACADhgAYCAALAAgCI ACFSEAAAAAAgAAAICIEIAAgCEBIAgQAEAAAAlgCYAAMYiICAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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