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Propargyl chloride C3H3Cl structure – Flashcards

Flashcard maker : Daniel Hardy

Contents

Experimental Melting Point:
Experimental Boiling Point:
Experimental Flash Point:
Experimental Gravity:
Experimental Refraction Index:
Safety:
Retention Index (Kovats):
Retention Index (Normal Alkane):

Molecular Formula	C₃H₃Cl
Average mass	74.509 Da
Density	1.0±0.1 g/cm³
Boiling Point	57.0±0.0 °C at 760 mmHg
Flash Point	18.9±0.0 °C
Molar Refractivity	18.6±0.3 cm³
Polarizability	7.4±0.5 10^-24cm³
Surface Tension	28.4±3.0 dyne/cm
Molar Volume	73.2±3.0 cm³

Experimental data
Predicted – ACD/Labs
Predicted – ChemAxon

Experimental Physico-chemical Properties
- Experimental Melting Point:
  
  <-50 °C Alfa Aesar L20416
- Experimental Boiling Point:
  
  60-63 °C Alfa Aesar L20416
  
  58 °C SynQuest 81342, 1500-5-02, 1500-5-04
  
  58 °C LabNetwork LN00182251
- Experimental Flash Point:
  
  -15 °C Alfa Aesar
  
  -15 °F (-26.1111 °C)
  Alfa Aesar L20416
  
  19 °C SynQuest 81342, 1500-5-02, 1500-5-04
  
  -14 °C LabNetwork LN00182251
- Experimental Gravity:
  
  20 g/mL SynQuest 1500-5-02, 1500-5-04
  
  0.99 g/mL Alfa Aesar L20416
  
  1.033 g/mL SynQuest 1500-5-02, 1500-5-04
- Experimental Refraction Index:
  
  1.4344 SynQuest 81342, 1500-5-02, 1500-5-04

Miscellaneous

Safety:

11-34-48/20-63-65-67 Alfa Aesar L20416

20-26-36/37/39-45-60 Alfa Aesar L20416

3 Alfa Aesar L20416

Danger Alfa Aesar L20416

H225-H304-H361-H373-H314-H336 Alfa Aesar L20416

Highly flammable/Toxic/Corrosive SynQuest 1500-5-04, 1500-5-02, 81342

IRRITANT Matrix Scientific 084156

P210-P301+P310-P303+P361+P353-P305+P351+P338-P405-P501a Alfa Aesar L20416

R11,R18,R23/24/25,R34,R41 SynQuest 1500-5-04, 1500-5-02

S13,S16,S23,S24/25,S26,S33,S36/37/39,S45 SynQuest 1500-5-04, 1500-5-02

Gas Chromatography

Retention Index (Kovats):

542 (estimated with error: 72) NIST Spectra mainlib_230373, replib_221904, replib_153521

Retention Index (Normal Alkane):

542 (Program type: Ramp; Column cl… (show more) ass: Standard non-polar; Column diameter: 0.20 mm; Column length: 25 m; Column type: Capillary; Heat rate: 6 K/min; Start T: 50 C; End T: 250 C; CAS no: 624657; Active phase: OV-101; Carrier gas: N2/He; Phase thickness: 0.10 um; Data type: Normal alkane RI; Authors: Zenkevich, I.G., Experimentally measured retention indices., 2005.) NIST Spectra nist ri

543.7 (Program type: Ramp; Column cl… (show more) ass: Standard non-polar; Column diameter: 0.2 mm; Column length: 50 m; Column type: Capillary; Heat rate: 2 K/min; Start T: 20 C; End T: 200 C; Start time: 5 min; CAS no: 624657; Active phase: Methyl Silicone; Carrier gas: N2; Data type: Normal alkane RI; Authors: Yasuhara, A.; Morita, M.; Fuwa, K., Temperature-programmed retention indices of 221 halogenated organic compounds with 1-bromoalkanes as references, J. Chromatogr., 328, 1985, 35-48.) NIST Spectra nist ri

Predicted data is generated using the ACD/Labs Percepta Platform – PhysChem Module

Density:	1.0±0.1 g/cm³
Boiling Point:	57.0±0.0 °C at 760 mmHg
Vapour Pressure:	234.7±0.1 mmHg at 25°C
Enthalpy of Vaporization:	28.7±3.0 kJ/mol
Flash Point:	18.9±0.0 °C
Index of Refraction:	1.423
Molar Refractivity:	18.6±0.3 cm³
#H bond acceptors:	0
#H bond donors:	0
#Freely Rotating Bonds:	1
#Rule of 5 Violations:	0

ACD/LogP:	0.99
ACD/LogD (pH 5.5):	1.32
ACD/BCF (pH 5.5):	5.90
ACD/KOC (pH 5.5):	123.96
ACD/LogD (pH 7.4):	1.32
ACD/BCF (pH 7.4):	5.90
ACD/KOC (pH 7.4):	123.96
Polar Surface Area:	0 Å²
Polarizability:	7.4±0.5 10^-24cm³
Surface Tension:	28.4±3.0 dyne/cm
Molar Volume:	73.2±3.0 cm³

Click to predict properties on the Chemicalize site

Propargyl chloride C3H3Cl structure – Flashcards

Experimental Melting Point:

Experimental Boiling Point:

Experimental Flash Point:

Experimental Gravity:

Experimental Refraction Index:

Safety:

Retention Index (Kovats):

Retention Index (Normal Alkane):

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