Hexadecanamide,N,N'-1,2-ethanediylbis- structure

3D Mol Similar

Hexadecanamide,N,N'-1,2-ethanediylbis-

Iupac Name：N-[2-(hexadecanoylamino)ethyl]hexadecanamide

CAS No.: 5518-18-3

Molecular Weight：536.93

Modify Date.: 2022-11-29 05:33

Introduction:

PelletsLargeCrystals

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1. Names and Identifiers

: 1.1 Name; Hexadecanamide,N,N'-1,2-ethanediylbis-

2. Properties

2.1 Density: 0.892

2.1 Melting point: 52.48 °C

2.1 Boiling point: 682.8°C at 760 mmHg

2.1 Refractive index: 1.466

2.1 Flash Point: 115.1°C

2.1 Precise Quality: 536.52800

2.1 PSA: 58.20000

2.1 logP: 10.96320

2.1 Appearance: PelletsLargeCrystals

2.2 Physical: PelletsLargeCrystals

3. Use and Manufacturing

3.1 GHS Classification: GHS Hazard Statements
Aggregated GHS information provided by 517 companies from 3 notifications to the ECHA C&L Inventory.

Reported as not meeting GHS hazard criteria by 513 of 517 companies. For more detailed information, please visit ECHA C&L website

Of the 1 notification(s) provided by 4 of 517 companies with hazard statement code(s):

H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]

Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown.

Precautionary Statement Codes
P273, and P501; View all

4. Safety and Handling

4.1 Hazard Declaration: H413

4.1 Caution Statement: P273, P501

5. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Hazardous to the aquatic environment, long-term (Chronic) - Category Chronic 4

2.2 GHS label elements, including precautionary statements

Pictogram(s)	No symbol.
Signal word	No signal word.
Hazard statement(s)	H413 May cause long lasting harmful effects to aquatic life
Precautionary statement(s)
Prevention	P273 Avoid release to the environment.
Response	none
Storage	none
Disposal	P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

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6. Synthesis Route

5518-18-3Total: 7 Synthesis Route

107-15-3

57-10-3 239 Suppliers

5518-18-3 2 Suppliers

Literatures:
Butler, Richard N.; Thornton, John D.; O'Regan, C.B. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1983 , p. 2197 - 2200
Yield: null

555-44-2 42 Suppliers

107-15-3

5518-18-3 2 Suppliers

Literatures:
Feairheller, S. H.; Bistline, R. G.; Bilyk, A.; Dudley, R. L.; Kozempel, M. F.; Haas, M. J. Journal of the American Oil Chemists' Society, 1994 , vol. 71, # 8 p. 863 - 866
Yield: ~85%

107-15-3

112-67-4 40 Suppliers

5518-18-3 2 Suppliers

Literatures:
Naudet et al. Bulletin de la Societe Chimique de France, 1954 , p. 1167,1168
Yield: null

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7. Precursor and Product

precursor:

628-97-7

112-67-4

57-10-3

555-44-2

6780-13-8

product :

10443-62-6

88122-40-1

8. Other Information

8.0 Manufacturing Info: Paper manufacturing|Hexadecanamide, N,N'-1,2-ethanediylbis-: ACTIVE

9. Computational chemical data

Molecular Weight: 536.93g/mol
Molecular Formula: C₃₄H₆₈N₂O₂
Compound Is Canonicalized: True
XLogP3-AA: 13.5
Exact Mass: 536.52807942
Monoisotopic Mass: 536.52807942
Complexity: 451
Rotatable Bond Count: 31
Hydrogen Bond Donor Count: 2
Hydrogen Bond Acceptor Count: 2
Topological Polar Surface Area: 58.2
Heavy Atom Count: 38
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 1
CACTVS Substructure Key Fingerprint: AAADcfB/MAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHgAQAAAACADBgAQCAALAAAAIAAEQEAAAAAAAAAAAAIEIAAAAQBIAgAAUAAAAFgCAAAEYiICAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

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N-[2-(Hexadecanoylamino)ethyl]hexadecanamide

Purity:99%Packing: 200kg/bag FOB
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Time: 2024/09/23

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N-[2-(hexadecanoylamino)ethyl]hexadecanamide