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Home> Hot Product Listed C   > Cyclohexanehexanamide, g-hydroxy-d-[[3-hydroxy-2-[[(1-naphthalenyloxy)acetyl]amino]-1-oxopropyl]amin...
66215-27-8 structure

Cyclohexanehexanamide, g-hydroxy-d-[[3-hydroxy-2-[[(1-naphthalenyloxy)acetyl]amino]-1-oxopropyl]amino]-a-(1-methylethyl)-N-[2-methyl-1-[[(2-pyridinylmethyl)amino]carbonyl]butyl]-,[aS-[N(1R*,2R*),aR*,gR*,dR*(R*)]]- (9CI)

Iupac Name:2-N-cyclopropyl-1,3,5-triazine-2,4,6-triamine
CAS No.:66215-27-8
Molecular Weight:166.1838
Molecular Formula:C8H12CL2O4 (isomer)
Names and Identifiers
Synonyms

(2S,4S)-6-cyclohexyl-4-hydroxy-5-[[(2S)-3-hydroxy-2-[(2-naphthalen-1-yloxyacetyl)amino]propanoyl]amino]-N-[(3S)-3-methyl-1-oxo-1-(pyridin-2-ylmethylamino)pentan-2-yl]-2-propan-2-ylhexanamide AC1NUJOY Cyclohexanehexanamide, .gamma.-hydroxy-.delta.-[[3-hydroxy-2-[[(1-naphthalenyloxy)acetyl]amino]-1-oxopropyl]amino]-.alpha.-(1-methylethyl)-N-[2-methyl-1-[[(2-pyridinylmethyl)amino]carbonyl]butyl]-, [a Cyclohexanehexanamide, gamma-hydroxy-delta-((3-hydroxy-2-(((1-naphthalenyloxy)acetyl)amino)-1-oxopropyl)amino)-alpha-(1-methylethyl)-N-(2-methyl-1-(((2-pyridinylmethyl)amino)carbonyl)butyl)-, (aS-(N(1R*,2R*),aR*,gR*,dR*(R*)))- Noa-Ser-CVA-Ile-Amp S-[N(1R*,2R*),aR*,gR*,dR*(R*)]]-

Inchi
InChI=1/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)
InChkey
LVQDKIWDGQRHTE-UHFFFAOYSA-N
Canonical Smiles
C1CC1NC2=NC(=NC(=N2)N)N
Properties
Density
1.14
Melting Point
220-222℃
Boiling Point
°Cat760mmHg
Flash Point
°C
Safety and Handling
Risk Statements
R36/37/38
Safety Statements
26-36
Transport
25kgs
Reach Info
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Hazardous to the aquatic environment, long-term (Chronic) - Category Chronic 2

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H411 Toxic to aquatic life with long lasting effects

Precautionary statement(s)
Prevention

P273 Avoid release to the environment.

Response

P391 Collect spillage.

Storage

none

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:166.1838g/mol
  • Molecular Formula:C8H12CL2O4
  • XLogP3-AA:_0.2
  • Exact Mass:166.096694
  • Monoisotopic Mass:166.096694
  • Complexity:148
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:3
  • Hydrogen Bond Acceptor Count:0
  • Topological Polar Surface Area:103
  • Heavy Atom Count:12
  • 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
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