2-Propylpiperidine hydrochloride structure

3D Mol Similar

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

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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

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5. Computational chemical data

Molecular Weight: 152.23g/mol
Molecular Formula: C_₁₁H_₁₀F_₃NO_₂
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

Can camphor auto ignite by using chemicals? Feb 18 2022
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.
Does camphor balls dissolve in water? Jan 01 2022
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.
At what temperature does camphor start to evaporate? Dec 29 2021
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 ...
Camphor for molecular mass determination Nov 14 2021
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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