![CAS 388079-60-5 (R)-1-[(R)-2-[2-(DIPHENYLPHOSPHINO)PHENYL]-FERROCENYL]ETHYLDICYCLOHEXYLPHOSPHINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/388079-60-5.gif)
CAS RN: 388079-60-5
(R)-1-[(R)-2-[2-(DIPHENYLPHOSPHINO)PHENYL]-FERROCENYL]ETHYLDICYCLOHEXYLPHOSPHINE
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3 package records0 with current stock1 grade group
- Product code: starshine_CAS388079-60-5
- Purity/Analytical Methods: >99.0%
388079-60-5 / phosphane
Basic Information
CAS
388079-60-5
Multi CAS
Yes
Molecular Formula
H3P
Molecular Weight
33.998000
Exact Mass
33.997237
InChI
InChI=1S/H3P/h1H3
InChIKey
XYFCBTPGUUZFHI-UHFFFAOYSA-N
Physical Properties
Melting Point
-207 °F (EPA, 1998)
-133.8 °C
-132.5 °C
-133 °C
-209 °F
Boiling Point
-126 °F at 760 mmHg (EPA, 1998)
-87.75 °C
-87.7 °C
-126 °F
Density
0.746 at -130 °F (EPA, 1998) - Less dense than water; will float
1.390 g/L at 25 °C
Density: 1.529 g/L at 0 °C
Density (gas): 1.53 kg/m³
Relative density (water = 1): 0.8
Physical Description
Phosphine appears as a colorless gas with a disagreeable odor of fish or garlic. Boiling point -126 °F; freezing point -209 °F. Very toxic by inhalation at extremely low concentrations. Prolonged heating may cause containers to rupture violently and rocket. Rate of onset: Immediate & Delayed (Lungs) Persistence: Minutes - hours Odor threshold: 0.9 ppm Source/use/other hazard: Insecticide; used in manufacture of flame retardants and incendiaries.
Gas or Vapor
Colorless gas with a fish- or garlic-like odor. [pesticide] [Note: Shipped as a liquefied compressed gas. Pure compound is odorless.] [NIOSH] Vapor density = 1.17 (heavier than air); [Burke, p. 102]
Liquid
COLOURLESS COMPRESSED LIQUEFIED GAS.
Appearance
Colorless gas; flammable
Colorless gas [Note: Shipped as a liquefied compressed gas].
State
Gas
Computed Properties
Structural Parameters
Heavy atom count
1
Molar refractivity
11.1
TPSA
0.0000
LogP / Solubility
WLOGP
0.06
MLOGP
0.03
XLogP3
-0.1
Consensus LogP
0.0000
Log S (ESOL)
-0.09
Class (ESOL)
Very soluble
Log S (Ali)
0.12
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.07
Class (SILICOS-IT)
Highly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.89
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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