成人免费xx,国产又黄又湿又刺激不卡网站,成人性视频app菠萝网站,色天天天天

Home Cart 0 Sign in  

[ CAS No. 108-33-8 ] {[proInfo.proName]}

,{[proInfo.pro_purity]}
Cat. No.: {[proInfo.prAm]}
Chemical Structure| 108-33-8
Chemical Structure| 108-33-8
Structure of 108-33-8 * Storage: {[proInfo.prStorage]}

Please Login or Create an Account to: See VIP prices and availability

Cart0 Add to My Favorites Add to My Favorites Bulk Inquiry Inquiry Add To Cart

Search after Editing

* Storage: {[proInfo.prStorage]}

* Shipping: {[proInfo.prShipping]}

Quality Control of [ 108-33-8 ]

Related Doc. of [ 108-33-8 ]

Alternatived Products of [ 108-33-8 ]
Product Citations

Product Details of [ 108-33-8 ]

CAS No. :108-33-8 MDL No. :MFCD00003110
Formula : C3H5N3S Boiling Point : No data available
Linear Structure Formula :- InChI Key :HMPUHXCGUHDVBI-UHFFFAOYSA-N
M.W : 115.16 Pubchem ID :66949
Synonyms :

Calculated chemistry of [ 108-33-8 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 7
Num. arom. heavy atoms : 5
Fraction Csp3 : 0.33
Num. rotatable bonds : 0
Num. H-bond acceptors : 2.0
Num. H-bond donors : 1.0
Molar Refractivity : 29.28
TPSA : 80.04 ?2

Pharmacokinetics

GI absorption : High
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) : -6.73 cm/s

Lipophilicity

Log Po/w (iLOGP) : 1.04
Log Po/w (XLOGP3) : 0.38
Log Po/w (WLOGP) : 0.44
Log Po/w (MLOGP) : -0.72
Log Po/w (SILICOS-IT) : 1.62
Consensus Log Po/w : 0.55

Druglikeness

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

Water Solubility

Log S (ESOL) : -1.32
Solubility : 5.49 mg/ml ; 0.0476 mol/l
Class : Very soluble
Log S (Ali) : -1.63
Solubility : 2.72 mg/ml ; 0.0236 mol/l
Class : Very soluble
Log S (SILICOS-IT) : -0.89
Solubility : 14.7 mg/ml ; 0.128 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 0.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 2.48

Safety of [ 108-33-8 ]

Signal Word:Warning Class:
Precautionary Statements:P261-P305+P351+P338 UN#:
Hazard Statements:H302-H315-H319-H335 Packing Group:
GHS Pictogram:

Application In Synthesis of [ 108-33-8 ]

* 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 [ 108-33-8 ]

[ 108-33-8 ] Synthesis Path-Downstream   1~5

  • 1
  • [ 108-33-8 ]
  • [ 53645-94-6 ]
  • 2
  • [ 108-33-8 ]
  • [ 54044-79-0 ]
YieldReaction ConditionsOperation in experiment
With hydrogen bromide; bromine; sodium nitrite; In water; at 0 - 10℃; for 1h; Into a 250-mL 3-necked round-bottom flask wereplaced 5-methyl-1,3,4-thiadiazol-2-amine (20.0 g, 173.68 mmol, 1.0 equiv) and HBr/H20 (50mL). This was followed by the addition of Br2 (50 mL) dropwise with stirring at 0C. To this was added a solution of NaNO2 (30.4 g, 440.58 mmol, 2.5 equiv) in water (50 mL) dropwise with stirring at 0-10C. The resulting solution was stirred for 1 h at 0C in a water/ice bath. The reaction was then quenched by the addition of Na25203 (sat., 100 mL). The pH value of thesolution was adjusted to 8-9 with sodium hydroxide (4 N). The resulting solution was extracted with DCM (3 x 500 mL) and the organic layers were combined, dried over anhydrous sodium sulfate and filtered. The filtrate was concentrated in vacuo to dryness to afford the title product.
  • 3
  • [ 108-33-8 ]
  • [ 58755-91-2 ]
  • [ 139477-27-3 ]
  • 4
  • [ 108-33-8 ]
  • [ 14437-03-7 ]
  • [ 60198-63-2 ]
  • 5
  • [ 108-33-8 ]
  • [ 12775-96-1 ]
  • [ 54044-79-0 ]
YieldReaction ConditionsOperation in experiment
With hydrogen bromide; sodium nitrite; Step 1 2-Bromo-5-methyl-1,3,4-thiadiazole To a solution of aqueous hydrobromic acid (48%, 40 mL) containing a trace amount of copper powder at -10 C. is added a mixture of 2-amino-5-methyl-1,3,4-thiadiazole (2.88 g) and sodium nitrite (7.76 g) portionwise over 45 mins with vigorous stirring. The resulting mixture is stirred at -10 C. for 1.5 hrs and at ambient temperature for an additional 1.5 hrs and is then cooled in an ice bath, neutralized with aqueous sodium hydroxide (50%), diluted with saturated aqueous sodium hydrogensulfite till the mixture no longer turns potassium iodide-starch test paper blue and filtered to remove insoluble material (rinsing with hot water). The filtrate is extracted with methylene chloride (4*100 mL), and the combined organic phase is dried over anhydrous sodium sulfate and concentrated under reduced pressure to give the crude produce which is then chromatographed on silica gel (70-230 mesh, 75 g), eluding with ethyl acetate/hexane (50/50). Pooling and concentration of those fractions with an Rf =0.78 by TLC (methanol/chloroform, 10/90) gives the title compound, mp 107-108 C.
Recommend Products
Same Skeleton Products

Technical Information

Historical Records

Related Functional Groups of
[ 108-33-8 ]

Amines

Chemical Structure| 15884-86-3

[ 15884-86-3 ]

5-(Methoxymethyl)-1,3,4-thiadiazol-2-amine

Similarity: 0.74

Chemical Structure| 4005-51-0

[ 4005-51-0 ]

1,3,4-Thiadiazol-2-amine

Similarity: 0.74

Chemical Structure| 2937-81-7

[ 2937-81-7 ]

1,3,4-Thiadiazole-2,5-diamine

Similarity: 0.72

Chemical Structure| 2349-67-9

[ 2349-67-9 ]

5-Amino-1,3,4-thiadiazole-2-thiol

Similarity: 0.62

Chemical Structure| 76074-47-0

[ 76074-47-0 ]

5-(m-tolyl)-1,3,4-Thiadiazol-2-amine

Similarity: 0.59

Related Parent Nucleus of
[ 108-33-8 ]

Thiadiazoles

Chemical Structure| 15884-86-3

[ 15884-86-3 ]

5-(Methoxymethyl)-1,3,4-thiadiazol-2-amine

Similarity: 0.74

Chemical Structure| 4005-51-0

[ 4005-51-0 ]

1,3,4-Thiadiazol-2-amine

Similarity: 0.74

Chemical Structure| 2937-81-7

[ 2937-81-7 ]

1,3,4-Thiadiazole-2,5-diamine

Similarity: 0.72

Chemical Structure| 2349-67-9

[ 2349-67-9 ]

5-Amino-1,3,4-thiadiazole-2-thiol

Similarity: 0.62

Chemical Structure| 76074-47-0

[ 76074-47-0 ]

5-(m-tolyl)-1,3,4-Thiadiazol-2-amine

Similarity: 0.59

; ;