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[ CAS No. 10323-20-3 ] {[proInfo.proName]}

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Cat. No.: {[proInfo.prAm]}
Chemical Structure| 10323-20-3
Chemical Structure| 10323-20-3
Structure of 10323-20-3 * Storage: {[proInfo.prStorage]}

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Quality Control of [ 10323-20-3 ]

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Product Details of [ 10323-20-3 ]

CAS No. :10323-20-3 MDL No. :MFCD00135608
Formula : C5H10O5 Boiling Point : -
Linear Structure Formula :HC(O)CH(OH)CH(OH)CH(OH)CH2OH InChI Key :PYMYPHUHKUWMLA-WDCZJNDASA-N
M.W : 150.13 Pubchem ID :66308
Synonyms :
D-(–)-Arabinose;D-Arabinose
Chemical Name :(2S,3R,4R)-2,3,4,5-Tetrahydroxypentanal

Calculated chemistry of [ 10323-20-3 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 10
Num. arom. heavy atoms : 0
Fraction Csp3 : 0.8
Num. rotatable bonds : 4
Num. H-bond acceptors : 5.0
Num. H-bond donors : 4.0
Molar Refractivity : 31.0
TPSA : 97.99 ?2

Pharmacokinetics

GI absorption : Low
BBB permeant : No
P-gp substrate : No
CYP1A2 inhibitor : No
CYP2C19 inhibitor : No
CYP2C9 inhibitor : No
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -8.86 cm/s

Lipophilicity

Log Po/w (iLOGP) : 0.26
Log Po/w (XLOGP3) : -2.32
Log Po/w (WLOGP) : -2.74
Log Po/w (MLOGP) : -2.48
Log Po/w (SILICOS-IT) : -1.29
Consensus Log Po/w : -1.71

Druglikeness

Lipinski : 0.0
Ghose : None
Veber : 0.0
Egan : 0.0
Muegge : 2.0
Bioavailability Score : 0.55

Water Solubility

Log S (ESOL) : 0.95
Solubility : 1350.0 mg/ml ; 9.01 mol/l
Class : Highly soluble
Log S (Ali) : 0.8
Solubility : 944.0 mg/ml ; 6.29 mol/l
Class : Highly soluble
Log S (SILICOS-IT) : 1.94
Solubility : 13000.0 mg/ml ; 86.9 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 1.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 2.81

Safety of [ 10323-20-3 ]

Signal Word:Warning Class:N/A
Precautionary Statements:P261-P305+P351+P338 UN#:N/A
Hazard Statements:H315-H319-H335 Packing Group:N/A
GHS Pictogram:

Application In Synthesis of [ 10323-20-3 ]

* 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.

  • Downstream synthetic route of [ 10323-20-3 ]

[ 10323-20-3 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 10323-20-3 ]
  • [ 30065-27-1 ]
  • C14H18N4O5S [ No CAS ]
YieldReaction ConditionsOperation in experiment
83% With acetic acid; In ethanol; for 10.0h;Reflux; General procedure: To solution of 4 (10 mmol) in absolute ethanol, different sugars (10 mmol) were added and then glacial acetic acid (1 ml) was added to the reaction mixture which was refluxed for 10h (TLC).The solvent was evaporated or concentrated under reduced pressure and the product was filtered off to afford 5(a-d) (83 - 88%) yields. L-(-)-Arabinose(2-mercaptobenzimidazole-1-1-yl) acetohydrazide (5a)Yellow powder (83%), m.p.182-184 C. Rf= 0.65 (5% MeOH in CH2Cl2), 1H NMR (DMSO-d6):δ = 3.12-3.85 (m, 5H, H-22, H-32, H-42, H-52, H-522), 2.75 (brs, 1H, OH), 3.52-3.61 (brs, 3H, 3xOH),4.05 (s, 2H, CH2), 4.95 (brs, 1H, NH), 6.95-7.32 (m,4H, Ar-H), 7.40 (brs, 1H, NH), 7.55 (s, 1H, CH).
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[ 10323-20-3 ]

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Reason: Stable Isotope

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