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[ CAS No. 506-32-1 ] {[proInfo.proName]}

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Cat. No.: {[proInfo.prAm]}
Chemical Structure| 506-32-1
Chemical Structure| 506-32-1
Structure of 506-32-1 * Storage: {[proInfo.prStorage]}
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Quality Control of [ 506-32-1 ]

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Product Details of [ 506-32-1 ]

CAS No. :506-32-1 MDL No. :MFCD00004417
Formula : C20H32O2 Boiling Point : -
Linear Structure Formula :- InChI Key :YZXBAPSDXZZRGB-DOFZRALJSA-N
M.W : 304.47 Pubchem ID :444899
Synonyms :
Immunocytophyt;Eicosatetraenoic acid (all cis-5,8,11,14);C20:4 (all cis-5,8,11,14) Fatty acid;Arachidonic acid (all cis-5,8,11,14);Arachidonate

Calculated chemistry of [ 506-32-1 ]

Physicochemical Properties

Num. heavy atoms : 22
Num. arom. heavy atoms : 0
Fraction Csp3 : 0.55
Num. rotatable bonds : 14
Num. H-bond acceptors : 2.0
Num. H-bond donors : 1.0
Molar Refractivity : 98.13
TPSA : 37.3 Ų

Pharmacokinetics

GI absorption : None
BBB permeant : None
P-gp substrate : None
CYP1A2 inhibitor : None
CYP2C19 inhibitor : None
CYP2C9 inhibitor : None
CYP2D6 inhibitor : None
CYP3A4 inhibitor : None
Log Kp (skin permeation) : None cm/s

Lipophilicity

Log Po/w (iLOGP) : None
Log Po/w (XLOGP3) : None
Log Po/w (WLOGP) : 6.22
Log Po/w (MLOGP) : None
Log Po/w (SILICOS-IT) : None
Consensus Log Po/w : None

Druglikeness

Lipinski : None
Ghose : None
Veber : None
Egan : None
Muegge : None
Bioavailability Score : None

Water Solubility

Log S (ESOL) : None
Solubility : None mg/ml ; None mol/l
Class : None
Log S (Ali) : None
Solubility : None mg/ml ; None mol/l
Class : None
Log S (SILICOS-IT) : None
Solubility : None mg/ml ; None mol/l
Class : None

Medicinal Chemistry

PAINS : None alert
Brenk : None alert
Leadlikeness : None
Synthetic accessibility : None

Safety of [ 506-32-1 ]

Signal Word:Warning Class:N/A
Precautionary Statements:P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313 UN#:N/A
Hazard Statements:H315-H319 Packing Group:N/A
GHS Pictogram:

Application In Synthesis of [ 506-32-1 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Upstream synthesis route of [ 506-32-1 ]
  • Downstream synthetic route of [ 506-32-1 ]

[ 506-32-1 ] Synthesis Path-Upstream   1~1

  • 1
  • [ 506-32-1 ]
  • [ 102-52-3 ]
  • [ 107-02-8 ]
Reference: [1] Human and Experimental Toxicology, 1999, vol. 18, # 11, p. 677 - 682
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Reason: Stable Isotope

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