3D Mol Similar

IMC-1C11

Iupac Name：1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide;hydrochloride

CAS No.：14252-80-3

Molecular Weight：324.893

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1. Names and Identifiers

1.1 Name: IMC-1C11

2. Properties

3.1 Density: 1.221

3.1 Melting point: 249-251 °C

3.1 Boiling point: 607.4°Cat760mmHg

3.1 Flash Point: 243.6°C

3.1 Vapour pressure: 2.24E-07mmHg at 25°C

3.1 Precise Quality: 324.19700

3.1 PSA: 32.34000

3.1 logP: 4.70940

3. Safety and Handling

4.1 Risk Statements: R26/27/28

4.1 Safety Statements: S22;S36/37/39;S45

4.1 Packing Group: III

4.1 Hazard Class: 6.1(b)

4.1 RIDADR: UN 2811

4.1 WGK Germany: 3

4.1 RTECS: TK6125000

4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 2

Acute toxicity - Dermal, Category 2

Acute toxicity - Inhalation, Category 1

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word	Danger
Hazard statement(s)	H300 Fatal if swallowed H310 Fatal in contact with skin H330 Fatal if inhaled
Precautionary statement(s)
Prevention	P264 Wash ... thoroughly after handling. P270 Do not eat, drink or smoke when using this product. P262 Do not get in eyes, on skin, or on clothing. P280 Wear protective gloves/protective clothing/eye protection/face protection. P260 Do not breathe dust/fume/gas/mist/vapours/spray. P271 Use only outdoors or in a well-ventilated area. P284 [In case of inadequate ventilation] wear respiratory protection.
Response	P301+P310 IF SWALLOWED: Immediately call a POISON CENTER/doctor/\u2026 P321 Specific treatment (see ... on this label). P330 Rinse mouth. P302+P352 IF ON SKIN: Wash with plenty of water/... P310 Immediately call a POISON CENTER/doctor/\u2026 P361+P364 Take off immediately all contaminated clothing and wash it before reuse. P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing. P320 Specific treatment is urgent (see ... on this label).
Storage	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

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5. Computational chemical data

Molecular Weight：324.893g/mol
Molecular Formula：
Compound Is Canonicalized：True
XLogP3-AA：
Exact Mass：324.1968412
Monoisotopic Mass：324.1968412
Complexity：321
Rotatable Bond Count：5
Hydrogen Bond Donor Count：2
Hydrogen Bond Acceptor Count：2
Topological Polar Surface Area：32.3
Heavy Atom Count：22
Defined Atom Stereocenter Count：0
Undefined Atom Stereocenter Count：1
Defined Bond Stereocenter Count：0
Undefined Bond Stereocenter Count：0
Isotope Atom Count：0
Covalently-Bonded Unit Count：2

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