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. 100-19-6 ] {[proInfo.proName]}

,{[proInfo.pro_purity]}
Cat. No.: {[proInfo.prAm]}
Chemical Structure| 100-19-6
Chemical Structure| 100-19-6
Structure of 100-19-6 * 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 [ 100-19-6 ]

Related Doc. of [ 100-19-6 ]

Alternatived Products of [ 100-19-6 ]
Product Citations

Product Citations

Jang, Mingyeong ; Lim, Taeho ; Park, Byoung Yong , et al. DOI: PubMed ID:

Abstract: In this study, we developed a metal-free and highly chemoselective method for the reduction of aromatic nitro compounds. This reduction was performed using tetrahydroxydiboron [B2(OH)4] as the reductant and 4,4'-bipyridine as the organocatalyst and could be completed within 5 min at room temperature. Under optimal conditions, nitroarenes with sensitive functional groups, such as vinyl, ethynyl, carbonyl, and halogen, were converted into the corresponding anilines with excellent selectivity while avoiding the undesirable reduction of the sensitive functional groups.

Purchased from AmBeed: ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ;

Product Details of [ 100-19-6 ]

CAS No. :100-19-6 MDL No. :MFCD00007355
Formula : C8H7NO3 Boiling Point : -
Linear Structure Formula :(NO2)C6H4COCH3 InChI Key :YQYGPGKTNQNXMH-UHFFFAOYSA-N
M.W : 165.15 Pubchem ID :7487
Synonyms :
Chemical Name :1-(4-Nitrophenyl)ethanone

Calculated chemistry of [ 100-19-6 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 12
Num. arom. heavy atoms : 6
Fraction Csp3 : 0.12
Num. rotatable bonds : 2
Num. H-bond acceptors : 3.0
Num. H-bond donors : 0.0
Molar Refractivity : 45.46
TPSA : 62.89 ?2

Pharmacokinetics

GI absorption : High
BBB permeant : Yes
P-gp substrate : No
CYP1A2 inhibitor : Yes
CYP2C19 inhibitor : No
CYP2C9 inhibitor : No
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -6.22 cm/s

Lipophilicity

Log Po/w (iLOGP) : 1.32
Log Po/w (XLOGP3) : 1.53
Log Po/w (WLOGP) : 1.8
Log Po/w (MLOGP) : 0.59
Log Po/w (SILICOS-IT) : -0.01
Consensus Log Po/w : 1.05

Druglikeness

Lipinski : 0.0
Ghose : None
Veber : 0.0
Egan : 0.0
Muegge : 1.0
Bioavailability Score : 0.55

Water Solubility

Log S (ESOL) : -2.07
Solubility : 1.42 mg/ml ; 0.00859 mol/l
Class : Soluble
Log S (Ali) : -2.46
Solubility : 0.573 mg/ml ; 0.00347 mol/l
Class : Soluble
Log S (SILICOS-IT) : -2.11
Solubility : 1.29 mg/ml ; 0.00783 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 2.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 1.38

Safety of [ 100-19-6 ]

Signal Word:Warning Class:N/A
Precautionary Statements:P280-P305+P351+P338 UN#:N/A
Hazard Statements:H302 Packing Group:N/A
GHS Pictogram:

Application In Synthesis of [ 100-19-6 ]

* 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 [ 100-19-6 ]
  • Downstream synthetic route of [ 100-19-6 ]

[ 100-19-6 ] Synthesis Path-Upstream   1~2

  • 1
  • [ 108-94-1 ]
  • [ 100-19-6 ]
  • [ 23600-83-1 ]
Reference： [1] Organic Letters, 2012, vol. 14, # 7, p. 1692 - 1695
  • 2
  • [ 100-19-6 ]
  • [ 98-80-6 ]
  • [ 23600-83-1 ]
Reference： [1] Angewandte Chemie - International Edition, 2019, [2] Angew. Chem., 2019, vol. 131, # 7, p. 2151 - 2155,5
Recommend Products
Same Skeleton Products

Technical Information

Historical Records

Related Functional Groups of
[ 100-19-6 ]

Aryls

Chemical Structure| 121-89-1

[ 121-89-1 ]

3'-Nitroacetophenone

Similarity: 0.98

Chemical Structure| 77344-68-4

[ 77344-68-4 ]

1-(2-Methyl-4-nitrophenyl)ethanone

Similarity: 0.96

Chemical Structure| 577-59-3

[ 577-59-3 ]

1-(2-Nitrophenyl)ethanone

Similarity: 0.94

Chemical Structure| 32580-41-9

[ 32580-41-9 ]

1-(2-Amino-5-nitrophenyl)ethanone

Similarity: 0.94

Chemical Structure| 24623-24-3

[ 24623-24-3 ]

6-Nitro-2,3-dihydro-1H-inden-1-one

Similarity: 0.93

Ketones

Chemical Structure| 121-89-1

[ 121-89-1 ]

3'-Nitroacetophenone

Similarity: 0.98

Chemical Structure| 77344-68-4

[ 77344-68-4 ]

1-(2-Methyl-4-nitrophenyl)ethanone

Similarity: 0.96

Chemical Structure| 577-59-3

[ 577-59-3 ]

1-(2-Nitrophenyl)ethanone

Similarity: 0.94

Chemical Structure| 32580-41-9

[ 32580-41-9 ]

1-(2-Amino-5-nitrophenyl)ethanone

Similarity: 0.94

Chemical Structure| 24623-24-3

[ 24623-24-3 ]

6-Nitro-2,3-dihydro-1H-inden-1-one

Similarity: 0.93

Nitroes

Chemical Structure| 121-89-1

[ 121-89-1 ]

3'-Nitroacetophenone

Similarity: 0.98

Chemical Structure| 77344-68-4

[ 77344-68-4 ]

1-(2-Methyl-4-nitrophenyl)ethanone

Similarity: 0.96

Chemical Structure| 577-59-3

[ 577-59-3 ]

1-(2-Nitrophenyl)ethanone

Similarity: 0.94

Chemical Structure| 32580-41-9

[ 32580-41-9 ]

1-(2-Amino-5-nitrophenyl)ethanone

Similarity: 0.94

Chemical Structure| 24623-24-3

[ 24623-24-3 ]

6-Nitro-2,3-dihydro-1H-inden-1-one

Similarity: 0.93

; ;