Found 13 results

Search term: MF = 'C_{4}H_{10}Cl_{2}Si'
ChemSpider 2D Image | MFCD00013608 | C4H10Cl2Si

MFCD00013608

  • Molecular FormulaC4H10Cl2Si
  • Average mass157.114 Da
  • Monoisotopic mass155.992889 Da
  • ChemSpider ID70647

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4518-94-9 [RN]
Dichlor(methyl)propylsilan [German] [ACD/IUPAC Name]
Dichloro(methyl)propylsilane [ACD/IUPAC Name]
Dichloro(méthyl)propylsilane [French] [ACD/IUPAC Name]
DICHLOROMETHYL-N-PROPYLSILANE
Methylpropyldichlorosilane
Methyl-propyl-dichlorosilane
MFCD00013608
Propylmethyldichlorosilane
Silane, dichloromethylpropyl- [ACD/Index Name]
More...

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1733841 [DBID]
68940_FLUKA [DBID]
NSC 96614 [DBID]
NSC96614 [DBID]
  • Gas Chromatography

    • Retention Index (Normal Alkane):

      796.7 (Program type: Isothermal; Col... (show more) umn class: Semi-standard non-polar; Column length: 2 m; Column type: Packed; CAS no: 4518949; Active phase: Lucopren G (silicone elastomer); Carrier gas: N2; Substrate: Celite 545 (0.12-0.15 mm); Data type: Normal alkane RI; Authors: Wurst, M.; Churacek, J., Analyse von organosiliciumverbindungen. VI. Retentionsindices der organosiliciumverbindungen bie der gaschromatographie, Collect. Czech. Chem. Commun., 36, 1971, 3497-3506.) NIST Spectra nist ri

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 127.8±8.0 °C at 760 mmHg
Vapour Pressure: 13.3±0.2 mmHg at 25°C
Enthalpy of Vaporization: 35.0±3.0 kJ/mol
Flash Point: 21.7±16.0 °C
Index of Refraction: 1.423
Molar Refractivity: 39.0±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.25
ACD/LogD (pH 5.5): 4.24
ACD/BCF (pH 5.5): 987.48
ACD/KOC (pH 5.5): 4842.66
ACD/LogD (pH 7.4): 4.24
ACD/BCF (pH 7.4): 987.48
ACD/KOC (pH 7.4): 4842.66
Polar Surface Area: 0 Å2
Polarizability: 15.5±0.5 10-24cm3
Surface Tension: 20.9±3.0 dyne/cm
Molar Volume: 153.1±3.0 cm3

Predicted data is generated using the US Environmental Protection Agency�s EPISuite™ 

                        
 Log Octanol-Water Partition Coef (SRC):
    Log Kow (KOWWIN v1.67 estimate) =  3.23

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.42):
    Boiling Pt (deg C):  95.58  (Adapted Stein & Brown method)
    Melting Pt (deg C):  -64.23  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  45.3  (Mean VP of Antoine & Grain methods)

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  123.9
       log Kow used: 3.23 (estimated)
       no-melting pt equation used

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  5.8811 mg/L

 ECOSAR Class Program (ECOSAR v0.99h):
    Class(es) found:
       Neutral Organics

 Henrys Law Constant (25 deg C) [HENRYWIN v3.10]:
   Bond Method :   3.26E-002  atm-m3/mole
   Group Method:   Incomplete
 Henrys LC [VP/WSol estimate using EPI values]:  7.559E-002 atm-m3/mole

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  3.23  (KowWin est)
  Log Kaw used:  0.125  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  3.105
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.6727
   Biowin2 (Non-Linear Model)     :   0.6852
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.8520  (weeks       )
   Biowin4 (Primary Survey Model) :   3.6211  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.3444
   Biowin6 (MITI Non-Linear Model):   0.2475
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.7289
 Ready Biodegradability Prediction:   NO

Hydrocarbon Biodegradation (BioHCwin v1.01):
    Structure incompatible with current estimation method!

 Sorption to aerosols (25 Dec C)[AEROWIN v1.00]:
  Vapor pressure (liquid/subcooled):  5.76E+003 Pa (43.2 mm Hg)
  Log Koa (Koawin est  ): 3.105
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  5.21E-010 
       Octanol/air (Koa) model:  3.13E-010 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  1.88E-008 
       Mackay model           :  4.17E-008 
       Octanol/air (Koa) model:  2.5E-008 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =   2.7294 E-12 cm3/molecule-sec
      Half-Life =     3.919 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =    47.026 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi): 3.02E-008 (Junge,Mackay)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (PCKOCWIN v1.66):
      Koc    :  178.2
      Log Koc:  2.251 

 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v1.67]:
    Rate constants can NOT be estimated for this structure!

 Bioaccumulation Estimates from Log Kow (BCFWIN v2.17):
   Log BCF from regression-based method = 1.784 (BCF = 60.88)
       log Kow used: 3.23 (estimated)

 Volatilization from Water:
    Henry LC:  0.0326 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      1.302  hours
    Half-Life from Model Lake :      119.3  hours   (4.971 days)

 Removal In Wastewater Treatment:
    Total removal:              92.88  percent
    Total biodegradation:        0.04  percent
    Total sludge adsorption:     4.31  percent
    Total to Air:               88.53  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       30.6            94.1         1000       
   Water     42              360          1000       
   Soil      26.2            720          1000       
   Sediment  1.09            3.24e+003    0          
     Persistence Time: 147 hr

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