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2-Propylpiperidine hydrochloride structure
2-Propylpiperidine hydrochloride structure

2-Propylpiperidine hydrochloride

Iupac Name:4,7,7-trimethylbicyclo[2.2.1]heptan-3-one
CAS No.: 76-22-2
Molecular Weight:152.23
Modify Date.: 2022-02-23 10:25
1. Names and Identifiers
1.1 Name
2-Propylpiperidine hydrochloride
1.2 Synonyms

(+/-)-2-PROPYLPIPERIDINE HYDROCHLORIDE 2-PROPYLPIPERIDINE HCL AKOS 220-97 CONIINE, DL- HCL DL-CICUTINE HYDROCHLORIDE DL-CONIINE HCL DL-CONIINE HYDROCHLORIDE

1.3 CAS No.
76-22-2
1.4 CID
2537
1.5 Molecular Formula
C11H10F3NO2 (isomer)
1.6 Inchi
InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3
1.7 InChkey
DSSYKIVIOFKYAU-UHFFFAOYSA-N
1.8 Canonical Smiles
CC1(C2CCC1(C(=O)C2)C)C
1.9 Isomers Smiles
CC1(C2CCC1(C(=O)C2)C)C
2. Properties
3.1 Density
1.097
3.1 Melting point
175-177 °C(lit.)
3.1 Boiling point
368.3°C at 760 mmHg
3.1 Refractive index
1.5462 (estimate)
3.1 Flash Point
235.1°C
3.1 Vapour pressure
4 mm Hg ( 70 °C)
3.1 Precise Quality
152.12000
3.1 PSA
17.07000
3.1 logP
2.40170
3. Safety and Handling
4.1 Symbol
GHS02, GHS07, GHS08
4.1 Signal Word
Warning
4.1 Risk Statements
11-22-36/37/38-20/21/22
4.1 Safety Statements
16-26-37/39
4.1 Packing Group
II
4.1 Hazard Class
6.1
4.1 Hazard Declaration
H228-H302 + H332-H371
4.1 RIDADR
UN 2717 4.1/PG 3
4.1 Caution Statement
P210-P260-P301 + P312 + P330-P370 + P378
4.1 WGK Germany
1
4.1 RTECS
EX1225000
4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Flammable solids, Category 2

Acute toxicity - Oral, Category 4

Acute toxicity - Inhalation, Category 4

Specific target organ toxicity \u2013 single exposure, Category 2

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H228 Flammable solid

H302 Harmful if swallowed

H332 Harmful if inhaled

H371 May cause damage to organs

Precautionary statement(s)
Prevention

P210 Keep away from heat, hot surfaces, sparks, open flames and other ignition sources. No smoking.

P240 Ground and bond container and receiving equipment.

P241 Use explosion-proof [electrical/ventilating/lighting/...] equipment.

P280 Wear protective gloves/protective clothing/eye protection/face protection.

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.

Response

P370+P378 In case of fire: Use ... to extinguish.

P301+P312 IF SWALLOWED: Call a POISON CENTER/doctor/\u2026if you feel unwell.

P330 Rinse mouth.

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

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

P308+P311 IF exposed or concerned: Call a POISON CENTER/doctor/...

Storage

P405 Store locked up.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

5. Computational chemical data
  • Molecular Weight: 152.23g/mol
  • Molecular Formula: C11H10F3NO2
  • Compound Is Canonicalized: True
  • XLogP3-AA: 2.2
  • Exact Mass: 152.120115130
  • Monoisotopic Mass: 152.120115130
  • Complexity: 217
  • Rotatable Bond Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Topological Polar Surface Area: 17.1
  • Heavy Atom Count: 11
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count: 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Isotope Atom Count: 0
  • Covalently-Bonded Unit Count: 1
6. Question & Answer
  • If you use a chemical to ignite it, then it’s not auto-ignition. What you would have is spontaneous combustion. If you added a chemical that caused an exit hermit reaction with the camphor, then you might get combustion.
  • No. Try lighter fluid, petrol, turps / white spirit, or acetone. Isopropyl alcohol, ethanol / meths, would probably also be ok. Camphor’s non-polar, water’s polar. So you gotta use a non-polar solvent.
  • The vapor pressure of any material is a function of temperature, the intermolecular forces. and the molecular weight and the molecular shape. As T is lowered the VP decreases and eventually becomes vanishingly low. I don’t think it really reaches zero until absolute zero[0K] but that is only what ...
  • I came across this statement in my book that read, "Camphor is used to determine the molecular mass of substances because it has a high value of cryoscopic constant." What does this have to do anything with the ease of determining molecular masses? I am not familiar with the process that is being r...
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