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(-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine

IUPAC: (2R,5S)-2,5-dimethyl-1-prop-2-enylpiperazine

CAS 155836-78-5
C9H18N2

(-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine (CAS 155836-78-5) is a chemical compound with molecular formula C9H18N2 and molecular weight 154.25 g/mol . GHS signal word: Warning. Hazard classifications: Flammable, Health Hazard.

What is (-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine?

Molecular Formula
C9H18N2
Molecular Weight
154.25 g/mol

Structure Identifiers

SMILES
C[C@@H]1CN[C@H](CN1CC=C)C
InChI
InChI=1S/C9H18N2/c1-4-5-11-7-8(2)10-6-9(11)3/h4,8-10H,1,5-7H2,2-3H3/t8-,9+/m0/s1
InChIKey
VKUXNUOPPQWDMV-DTWKUNHWSA-N

Properties

Computed

Calculated molecular descriptors used in drug design and computational chemistry.

Exact Mass
154.1470 Da
XLogP
1.10
TPSA
15.3 Ų
H-Bond Donors
1
H-Bond Acceptors
2
Complexity
134
Formal Charge
0

Safety information

Signal Word

Warning

GHS Pictograms

GHS pictogram: Flammable GHS02
GHS pictogram: Health Hazard GHS07

Hazard Statements

  • H226 Flammable liquid and vapour

Precautionary Statements

  • P210 Keep away from heat/sparks/open flames/hot surfaces - No smoking
  • P233 Keep container tightly closed
  • P240 Ground/bond container and receiving equipment
  • P241 Use explosion-proof electrical/ventilating/lighting equipment
  • P242 Use only non-sparking tools
  • P243 Take precautionary measures against static discharge
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray
  • P264 Wash thoroughly after handling
  • P270 Do not eat, drink or smoke when using this product
  • P271 Use only outdoors or in a well-ventilated area
  • P280 Wear protective gloves/protective clothing/eye protection/face protection
  • P302+P352 IF ON SKIN: Wash with soap and water
  • P303+P361+P353 IF ON SKIN (or hair): Remove/Take off immediately all contaminated clothing. Rinse skin with water/shower
  • P304+P340 IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing
  • P305+P351+P338 IF IN EYES: Rinse continuously with water for several minutes. Remove contact lenses if present and easy to do, continue rinsing
  • P321 Specific treatment (see supplemental first aid instructions on this label)
  • P330 Rinse mouth
  • P370+P378 In case of fire: Use appropriate media for extinction
  • P403+P233 Store in a well-ventilated place. Keep container tightly closed
  • P403+P235 Store in a well-ventilated place. Keep cool
  • P405 Store locked up
  • P501 Dispose of contents/container to an approved waste disposal plant

Synonyms (23)

  • FA17303
  • DB-246886
  • CS-0447424
  • 155766-33-9
  • 155836-78-5
  • MFCD09753425
  • AKOS006329024
  • SCHEMBL231228
  • RefChem:397667
  • DTXSID401235781
  • VKUXNUOPPQWDMV-DTWKUNHWSA-N
  • trans-1-allyl-2,5-dimethylpiperazine
  • (2R,5S)-1-Allyl-2,5-dimethylpiperazine
  • (+/-)-TRANS-1-ALLYL-2 5-DIMETHYLPIPERAZ
  • (2R, 5S)-1-allyl-2,5-dimethylpiperazine
  • (-)-(2R,5S)-1-Allyl-2,5-dimethylpiperazine
  • (+/-)-trans-1-Allyl-2,5-dimethylpiperazine
  • (-)-(2r, 5s)-1-allyl-2,5-dimethylpiperazine
  • (2R,5S)-2,5-dimethyl-1-prop-2-enylpiperazine
  • (+/-)-trans-1-Allyl-2,5-dimethylpiperazine, 97%
  • (2R-trans)-2,5-Dimethyl-1-(2-propenyl)piperazine
  • (2R,5S)-2,5-Dimethyl-1-(2-propen-1-yl)piperazine
  • (2R,5S)-2,5-DIMETHYL-1-(PROP-2-EN-1-YL)PIPERAZINE

Frequently asked questions

What is the CAS number of (-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine?

The CAS Registry Number for (-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine is 155836-78-5.

What is the IUPAC name of (-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine?

The IUPAC name of (-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine is (2R,5S)-2,5-dimethyl-1-prop-2-enylpiperazine.

What is the molecular formula of (-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine?

(-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine has the molecular formula C9H18N2 and a molecular weight of 154.25 g/mol.

What is the SMILES notation for (-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine?

The SMILES notation for (-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine is C[C@@H]1CN[C@H](CN1CC=C)C.

Is (-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine hazardous?

(-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine carries the following GHS hazard classifications: Flammable, Health Hazard. Signal word: Warning.

What are other names for (-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine?

(-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine is also known as (-)-(2r, 5s)-1-allyl-2,5-dimethylpiperazine, (-)-(2R,5S)-1-Allyl-2,5-dimethylpiperazine, (+/-)-TRANS-1-ALLYL-2 5-DIMETHYLPIPERAZ, (+/-)-trans-1-Allyl-2,5-dimethylpiperazine, (+/-)-trans-1-Allyl-2,5-dimethylpiperazine, 97%.

Data sourced from PubChem CID 10534891. Last updated .

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