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Home> Encyclopedia > Hot Product Listed 5   > 5'-Cytidylic acid,2',3'-dideoxy-, mono[2,3-bis[(1-oxo-9-octadecenyl)oxy]propyl] ester, (Z,Z)-(9CI)
15442-91-8 structure

5'-Cytidylic acid,2',3'-dideoxy-, mono[2,3-bis[(1-oxo-9-octadecenyl)oxy]propyl] ester, (Z,Z)-(9CI)

Iupac Name:1,2,4,5-tetrakis(bromomethyl)benzene
CAS No.:15442-91-8
Molecular Weight:449.8024
Molecular Formula:C16H9N3O2 (isomer)
Names and Identifiers
Synonyms

1,2-dioleoyl-glycero-3-phospho-5'-(2',3')-dideoxycytidine

Inchi
InChI=1/C10H10Br4/c11-3-7-1-8(4-12)10(6-14)2-9(7)5-13/h1-2H,3-6H2
Canonical Smiles
C1=C(C(=CC(=C1CBr)CBr)CBr)CBr
Properties
Density
1.267
Melting Point
159-161 °C(lit.)
Boiling Point
402.3°Cat760mmHg
Vapour
1.62E-06mmHg at 25°C
Refractive Index
1.663
HS Code
2903999090
Safety and Handling
Risk Statements
R34
Safety Statements
S26
HazardClass
8
PackingGroup
III
Transport
UN 3261 8/PG 2
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Skin corrosion, Category 1B

Specific target organ toxicity – single exposure, Category 3

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H314 Causes severe skin burns and eye damage

H335 May cause respiratory irritation

Precautionary statement(s)
Prevention

P260 Do not breathe dust/fume/gas/mist/vapours/spray.

P264 Wash ... thoroughly after handling.

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

P261 Avoid breathing dust/fume/gas/mist/vapours/spray.

P271 Use only outdoors or in a well-ventilated area.

Response

P301+P330+P331 IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.

P303+P361+P353 IF ON SKIN (or hair): Take off immediately all contaminated clothing. Rinse skin with water [or shower].

P363 Wash contaminated clothing before reuse.

P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing.

P310 Immediately call a POISON CENTER/doctor/…

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

P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

P312 Call a POISON CENTER/doctor/…if you feel unwell.

Storage

P405 Store locked up.

P403+P233 Store in a well-ventilated place. Keep container tightly closed.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:449.8024g/mol
  • Molecular Formula:C16H9N3O2
  • Exact Mass:449.747508
  • Monoisotopic Mass:445.751601
  • Complexity:128
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:0
  • Topological Polar Surface Area:0
  • Heavy Atom Count:14
  • 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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