3D Mol Similar

BOMIWLCNCJKWPE-UHFFFAOYSA-N

Iupac Name：sodium;hypochlorite

CAS No.: 7681-52-9

Molecular Weight：74.439

Modify Date.: 2022-04-16 08:05

Request For Quotation

1. Names and Identifiers

1.1 Name: BOMIWLCNCJKWPE-UHFFFAOYSA-N
1.2 Synonyms: 5-fluoro-2-(4-methyl-1-piperazinyl)benzaldehyde 5-fluoro-2-(4-methyl-piperazin-1-yl)-benzaldehyde AKOS009463386 DB-076674 FT-0712410 ZINC37233687

1.3 CAS No.: 7681-52-9

1.4 CID: 23665760

1.5 Molecular Formula: C₁₁H₁₆N₂ (isomer)

1.6 Inchi: InChI=1S/ClO.Na/c1-2;/q-1;+1

1.7 InChkey: SUKJFIGYRHOWBL-UHFFFAOYSA-N

1.8 Canonical Smiles: [O-]Cl.[Na+]

1.9 Isomers Smiles: [O-]Cl.[Na+]

2. Properties

3.1 Melting point: -16 °C

3.1 Refractive index: 1.3870

3.1 Vapour pressure: Vapor pressure, kPa at 20 °C: 2 - 2.5

3.1 Precise Quality: 73.95350

3.1 PSA: 23.06000

3.1 logP: 0.57070

3. Safety and Handling

4.1 Symbol: GHS05;GHS09;

4.1 Signal Word: DANGER

4.1 Risk Statements: 31-34-36/38-36/37/38

4.1 Safety Statements: 26-36/37/39-45-50A-28A-36

4.1 Packing Group: III

4.1 Hazard Class: 8

4.1 Hazard Declaration: H315; H318; H400

4.1 RIDADR: UN 1791

4.1 Caution Statement: P273; P280; P303 + P361 + P353; P304 + P340 + P310; P305 + P351 + P338; P391

4.1 WGK Germany: 2

4.1 RTECS: NH3486300

4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Skin corrosion, Category 1B

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

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word	Danger
Hazard statement(s)	H314 Causes severe skin burns and eye damage H400 Very toxic to aquatic life
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. P273 Avoid release to the environment.
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. P391 Collect spillage.
Storage	P405 Store locked up.
Disposal	P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

View all

5. Computational chemical data

Molecular Weight: 74.439g/mol
Molecular Formula: C_₁₁H_₁₆N_₂
Compound Is Canonicalized: True
XLogP3-AA: null
Exact Mass: 73.9535366
Monoisotopic Mass: 73.9535366
Complexity: 4.8
Rotatable Bond Count: 0
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 1
Topological Polar Surface Area: 23.1
Heavy Atom Count: 3
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
CACTVS Substructure Key Fingerprint: AAADcQAAICAEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

6. Question & Answer

Which is a better disinfectant, sodium hypochlorite or chlorine dioxide? Apr 17 2022
More or less chlorine dioxide. It has the advantage of being a gas, so it can be used to disinfect the interior of an entire building. It’s also highly effective against many water-borne pathogens. Of course, ‘better’ can mean different things in different situations. I can buy sodium hypochlori...
Can sodium hypochlorite abort a five month old pregnancy? Mar 30 2022
No. The only chemicals that have been scientifically evaluated and shown to safely and effectively abort an early pregnancy are mifepristone and misoprostol together, or misoprostol on its own. Misoprostol can be used up until 12 weeks of pregnancy - after that, it’s used differently. For more inf...
What are the hazards of sodium hypochlorite? Mar 30 2022
First things first…always check the MSDS and RKHSL. Secondly, wear protective eye wear, respirator mask and gloves before handling. Exposure can cause irritation and/or burning to the skin, nose, throat, lungs and eyes, headache and/or dizziness, nausea and/or vomiting and pulmonary edema in cases...
How do you prepare a 2.5 %w/v sodium hypochlorite solution? Mar 19 2022
2.5% w/v of sodium hypochlorite solution (NaClO) = 2.5g of NaClO/100mL solution Weigh out 2.5g of NaClO and put it into a 100mL graduated measuring cylinder or 100mL volumetric flask, add a small amount of water, shake it to dissolve and finally add water to the mark.

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