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Home> Hot Product Listed 4   > 4,4-DIMETHYL-2-NEOPENTYLPENTANAL
13597-46-1 structure

4,4-DIMETHYL-2-NEOPENTYLPENTANAL

Iupac Name:zinc selenite
CAS No.:13597-46-1
Molecular Weight:192.3672
Molecular Formula:C9H9F3N2O (isomer)
Names and Identifiers
Synonyms

2-(2,2-dimethylpropyl)-4,4-dimethylpentanal 4,4-dimethyl-2-(2,2-dimethyl-propyl)-pentanal

Inchi
InChI=1/H2O3Se.Zn/c1-4(2)3;/h(H2,1,2,3);/q;+2/p-2
Canonical Smiles
[O-][Se](=O)[O-].[Zn+2]
Properties
Melting Point
618
Safety and Handling
Risk Statements
R23/25;R33;R50/53
Safety Statements
S20/21;S28;S45;S60;S61
HazardClass
6.1
PackingGroup
I
Transport
UN 2630
Reach Info
This substance has been officially registered by enterprises.
ECHA (EU chemicals Management Agency) published the completed registration file as follows:
Completed registration file:
Registered as ubmitted Total tonnage band  
FULL JOINT 10_100 view >
Registered companies:
Registrant / Supplier details Latest dossier received
RETORTE GmbH 2015
Vital MATERIALS EUROPE BVBA 2016
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 3

Acute toxicity - Inhalation, Category 3

Specific target organ toxicity \u2013 repeated exposure, Category 2

Hazardous to the aquatic environment, short-term (Acute) - Category Acute 1

Hazardous to the aquatic environment, long-term (Chronic) - Category Chronic 1

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H301 Toxic if swallowed

H331 Toxic if inhaled

H373 May cause damage to organs through prolonged or repeated exposure

H400 Very toxic to aquatic life

H411 Toxic to aquatic life with long lasting effects

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

P270 Do not eat, drink or smoke when using this product.

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

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

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

P273 Avoid release to the environment.

Response

P301+P310 IF SWALLOWED: Immediately call a POISON CENTER/doctor/\u2026

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

P330 Rinse mouth.

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

P311 Call a POISON CENTER/doctor/\u2026

P314 Get medical advice/attention if you feel unwell.

P391 Collect spillage.

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:192.3672g/mol
  • Molecular Formula:C9H9F3N2O
  • Exact Mass:191.830412
  • Monoisotopic Mass:191.830412
  • Complexity:18.8
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:63.2
  • Heavy Atom Count:5
  • 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:2
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Recommended Suppliers
  • Tel:+86-0592-5567629
  • Fax:+86-0592-5567629
  • Tel:+86-027-59599243
  • Fax:
  • Tel:+86-371- 55366292
  • Fax:
  • Tel:+86-571-88025872, 28272092, 28272096
  • Fax:
  • Tel:+1-(604)-438-7428
  • Fax:+1-(604)-438-7408
  • Tel:+1-770-9436202
  • Fax:+1-770-4390369
  • Tel:86-10-58478363
  • Fax:86-10-58478363
 
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