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Home> Hot Product Listed 2   > 2-Propenoic acid,1,1'-(3,6,9,12,15-pentaoxaheptadecane-1,17-diyl) ester
216159-03-4 structure

2-Propenoic acid,1,1'-(3,6,9,12,15-pentaoxaheptadecane-1,17-diyl) ester

Iupac Name:4-bromo-2-fluorobenzenesulfonyl chloride
CAS No.:216159-03-4
Molecular Weight:273.5
Molecular Formula:C21H32CLNO2 (isomer)
Names and Identifiers
Synonyms

2-Propenoicacid, 3,6,9,12,15-pentaoxaheptadecane-1,17-diyl ester (9CI) Hexaethyleneglycoldiacrylate

Inchi
InChI=1S/C6H3BrClFO2S/c7-4-1-2-6(5(9)3-4)12(8,10)11/h1-3H
InChkey
XNYBZLRIUHNRQY-UHFFFAOYSA-N
Canonical Smiles
C1=CC(=C(C=C1Br)F)S(=O)(=O)Cl
Properties
Density
1.043
Melting Point
63-66℃
Boiling Point
405.8°C at 760 mmHg
Vapour
2.04mmHg at 25°C
Refractive Index
1.449
Flash Point
153.1ºC
HS Code
2904909090
Safety and Handling
Risk Statements
R34
Safety Statements
S22;S26;S36/37/39;S45
HazardClass
8
PackingGroup
II
Transport
UN 3261
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Skin corrosion, Category 1B

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H314 Causes severe skin burns and eye damage

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.

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/\u2026

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.

Storage

P405 Store locked up.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:273.5g/mol
  • Molecular Formula:C21H32CLNO2
  • Compound Is Canonicalized:True
  • Exact Mass:271.871
  • Monoisotopic Mass:271.871
  • Complexity:251
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:42.5A^2
  • 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
  • CACTVS Substructure Key Fingerprint: AAADcQBgMQBEEAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGQRAAAABqACAUAgwAYAAAAKA ACBCAHBCAAAgAAQIiBgAAKgIICKAERCAIAAggAAIihcAAAAAAAEAAAAAAAAAAgAAAAAAAAAAAAAA AA==
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