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4-IODO-2-METHOXYBENZOIC ACID structure
4-IODO-2-METHOXYBENZOIC ACID structure

4-IODO-2-METHOXYBENZOIC ACID

Iupac Name:disodium;dioxido(oxo)silane
CAS No.: 1344-09-8
Molecular Weight:122.062
Modify Date.: 2022-04-19 18:24
1. Names and Identifiers
1.1 Name
4-IODO-2-METHOXYBENZOIC ACID
1.2 CAS No.
1344-09-8
1.3 CID
23266
1.4 Molecular Formula
C9H10ClNO (isomer)
1.5 Inchi
InChI=1S/2Na.O3Si/c;;1-4(2)3/q2*+1;-2
1.6 InChkey
NTHWMYGWWRZVTN-UHFFFAOYSA-N
1.7 Canonical Smiles
[O-][Si](=O)[O-].[Na+].[Na+]
1.8 Isomers Smiles
[O-][Si](=O)[O-].[Na+].[Na+]
2. Properties
3.1 Density
1.271
3.1 Melting point
1410 °C(lit.)
3.1 Boiling point
211.4±15.0 °C at 760 mmHg (Predicted)
3.1 Refractive index
1.512 - 1.514
3.1 Flash Point
249.2°C
3.1 Precise Quality
121.94100
3.1 PSA
63.19000
3.1 logP
-0.73720
3. Safety and Handling
4.1 Risk Statements
R36/38
4.1 Safety Statements
S26;S28
4.1 Packing Group
II
4.1 Hazard Class
8
4.1 RIDADR
UN 2922 8/PG 2
4.1 WGK Germany
2
4.1 RTECS
VW0400000
4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Corrosive to metals, Category 1

Skin corrosion, Category 1B

Serious eye damage, Category 1

Specific target organ toxicity \u2013 single exposure, Category 3

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H290 May be corrosive to metals

H314 Causes severe skin burns and eye damage

H335 May cause respiratory irritation

Precautionary statement(s)
Prevention

P234 Keep only in original packaging.

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

P390 Absorb spillage to prevent material damage.

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.

P312 Call a POISON CENTER/doctor/\u2026if you feel unwell.

Storage

P406 Store in a corrosion resistant/...container with a resistant inner liner.

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

5. Computational chemical data
  • Molecular Weight: 122.062g/mol
  • Molecular Formula: C9H10ClNO
  • Compound Is Canonicalized: True
  • XLogP3-AA: null
  • Exact Mass: 121.94120896
  • Monoisotopic Mass: 121.94120896
  • 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: 6
  • 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: 3
  • CACTVS Substructure Key Fingerprint: AAADcQAAMDgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
6. Question & Answer
  • Sodium silicate, formula Na₂SiO₃, is industrially synthesised by formally reacting sodium oxide, Na₂O, with silicon dioxide, SiO₂. However, since Na₂O is not readily available and very reactive, a preferred way is the high temperature reaction between SiO₂ and sodium carbonate, Na₂CO₃: SiO₂ + Na₂CO...
  • I, and many other people, use it to harden the surface of a freshly thrown pot with a hair dryer, and push out from inside to create crackles. I also use it to make “magic slip” and “magic water” to repair leatherhard of bone dry items (with soda ash and paper pulp). It is also a popular defloc...
  • I recently discovered (through Wikipedia) that water glass / sodium Silicate dissolves in water (22 g / 100 ml @ 25 degrees and 160 g / 100 ml @ 80 degrees). Doesn't that mean it'll dissolve in acetone?
  • In this question , the user asked about curing sodium silicate with calcium chloride. My question is, will the resultant product be insoluble in water? I know calcium silicate is only very slightly soluble, but I'm expecting it's going to be a bit more complicated than that. I'm not a chemist, and ...
8. Realated Product Infomation