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Home> Encyclopedia >   /  Food Additives  /  Carbonate  /  Other Inorganic Salts  /  Inorganic Acids  /  Others
Cyclopenta[c]pyrrole-1-methanol,octahydro-5-methyl-, (1S,3aR,6aS)- structure
Cyclopenta[c]pyrrole-1-methanol,octahydro-5-methyl-, (1S,3aR,6aS)- structure

Cyclopenta[c]pyrrole-1-methanol,octahydro-5-methyl-, (1S,3aR,6aS)-

Iupac Name:dipotassium;carbonate
CAS No.:584-08-7
Molecular Weight:138.21
1. Names and Identifiers
1.1 Name
Cyclopenta[c]pyrrole-1-methanol,octahydro-5-methyl-, (1S,3aR,6aS)-
1.2 Synonyms

cyclopenta[c]pyrrole-1-methanol, octahydro-5-methyl-, (1s,3ar,6as)- (9ci)

1.3 CAS No.
584-08-7
1.4 CID
11430
1.5 Molecular Formula
C14H26O2 (isomer)
1.6 Inchi
InChI=1S/CH2O3.2K/c2-1(3)4;;/h(H2,2,3,4);;/q;2*+1/p-2
1.7 InChkey
BWHMMNNQKKPAPP-UHFFFAOYSA-L
1.8 Canonical Smiles
C(=O)([O-])[O-].[K+].[K+]
1.9 Isomers Smiles
C(=O)([O-])[O-].[K+].[K+]
2. 3D Conformer
3. Properties
3.1 Melting Point
891 °C(lit.)
4. Safety and Handling
4.1 Risk Statements
22-36/37/38-20/21/22
4.2 Safety Statements
26-36-37/39
4.3 Hazard Note
H302; H315; H319; H335
4.4 PackingGroup
III
4.5 Transport
3262
5. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Skin irritation, Category 2

Eye irritation, Category 2

Specific target organ toxicity \u2013 single exposure, Category 3

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H315 Causes skin irritation

H319 Causes serious eye irritation

H335 May cause respiratory irritation

Precautionary statement(s)
Prevention

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

P302+P352 IF ON SKIN: Wash with plenty of water/...

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

P332+P313 If skin irritation occurs: Get medical advice/attention.

P362+P364 Take off contaminated clothing and wash it before reuse.

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

P337+P313 If eye irritation persists: Get medical advice/attention.

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

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

Storage

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

P405 Store locked up.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

6. Computational chemical data
  • Molecular Weight:138.21g/mol
  • Molecular Formula:C14H26O2
  • Compound Is Canonicalized:True
  • Exact Mass:137.912
  • Monoisotopic Mass:137.912
  • Complexity:18.8
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:63.2A^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: AAADcQAAMAAAYAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAAAAAAAAAAAAACAAAAAAI AAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
8. Question & Answer
  • I am carrying out a reaction using ethyl chloroacetate, potassium carbonate in acetone for a compound containing − N H " style="position: relative;" tabindex="0" id="MathJax-Element-2-Frame" class="MathJax" ? N H ? N H group. So, the substitution will be at − N H " style="posi...
  • They seem all correct to me, is there any reason why one reaction would happen over the other(s)? K X 2 C O X 3 + 2 H C l ⟶ 2 K C l + H X 2 C O X 3 K X 2 C O X 3 + 2 H C l ⟶ 2 K C l + H X 2 O + C O X 2 K X 2 C O X 3 + H C l ⟶ K H C O X 3 + H X 2 O " style="text-alig...
  • Context: In the process of trying to calibrate a number of hygrometers, with Sensirion MEMS electronic sensors, I came across the method of using wet salt: an airtight container will stabilize at a predictable relative humidity over time, given a particular salt and temperature. For a list of salts...
  • In our village, lots of ash is produced which is thrown off. I want to extract pure potassium carbonate from that ash. I am able to extract the potassium compound and a soluble compound by recrystallizing and evaporating but I found impurities. The first test I performed is electrolysis. This test ...
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