天堂网亚洲,天天操天天搞,91视频高清,菠萝蜜视频在线观看入口,美女视频性感美女视频,95丝袜美女视频国产,超高清美女视频图片

Home Cart 0 Sign in  

[ CAS No. 2745-26-8 ] {[proInfo.proName]}

,{[proInfo.pro_purity]}
Cat. No.: {[proInfo.prAm]}
Chemical Structure| 2745-26-8
Chemical Structure| 2745-26-8
Structure of 2745-26-8 * 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 [ 2745-26-8 ]

Related Doc. of [ 2745-26-8 ]

Alternatived Products of [ 2745-26-8 ]
Product Citations

Product Details of [ 2745-26-8 ]

CAS No. :2745-26-8 MDL No. :MFCD00798036
Formula : C6H6O3 Boiling Point : -
Linear Structure Formula :C4H3OCH2COOH InChI Key :VYSRZETUSAOIMP-UHFFFAOYSA-N
M.W : 126.11 Pubchem ID :75974
Synonyms :

Calculated chemistry of [ 2745-26-8 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 9
Num. arom. heavy atoms : 5
Fraction Csp3 : 0.17
Num. rotatable bonds : 2
Num. H-bond acceptors : 3.0
Num. H-bond donors : 1.0
Molar Refractivity : 30.25
TPSA : 50.44 ?2

Pharmacokinetics

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) : -7.01 cm/s

Lipophilicity

Log Po/w (iLOGP) : 1.09
Log Po/w (XLOGP3) : 0.08
Log Po/w (WLOGP) : 0.91
Log Po/w (MLOGP) : -0.25
Log Po/w (SILICOS-IT) : 0.96
Consensus Log Po/w : 0.56

Druglikeness

Lipinski : 0.0
Ghose : None
Veber : 0.0
Egan : 0.0
Muegge : 1.0
Bioavailability Score : 0.56

Water Solubility

Log S (ESOL) : -0.95
Solubility : 14.1 mg/ml ; 0.112 mol/l
Class : Very soluble
Log S (Ali) : -0.69
Solubility : 25.5 mg/ml ; 0.203 mol/l
Class : Very soluble
Log S (SILICOS-IT) : -1.35
Solubility : 5.67 mg/ml ; 0.045 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 0.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 2.02

Safety of [ 2745-26-8 ]

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

Application In Synthesis of [ 2745-26-8 ]

* 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 [ 2745-26-8 ]
Recommend Products
Same Skeleton Products

Technical Information

Historical Records

Related Functional Groups of
[ 2745-26-8 ]

Carboxylic Acids

Chemical Structure| 935-13-7

[ 935-13-7 ]

3-(Furan-2-yl)propanoic acid

Similarity: 0.84

Chemical Structure| 62119-70-4

[ 62119-70-4 ]

2-Benzofuranacetic acid

Similarity: 0.82

Chemical Structure| 90484-22-3

[ 90484-22-3 ]

Benzofuran-7-carboxylic acid

Similarity: 0.69

Chemical Structure| 20811-60-3

[ 20811-60-3 ]

3-(4-Methoxyphenoxy)propanoic acid

Similarity: 0.69

Chemical Structure| 7170-38-9

[ 7170-38-9 ]

3-Penoxypropionic acid

Similarity: 0.69

Related Parent Nucleus of
[ 2745-26-8 ]

Furans

Chemical Structure| 935-13-7

[ 935-13-7 ]

3-(Furan-2-yl)propanoic acid

Similarity: 0.84

Chemical Structure| 3208-16-0

[ 3208-16-0 ]

2-Ethylfuran

Similarity: 0.72

Chemical Structure| 10599-59-4

[ 10599-59-4 ]

2-Isopropylfuran

Similarity: 0.71

Chemical Structure| 21984-93-0

[ 21984-93-0 ]

5-Methylfuran-3-carboxylic acid

Similarity: 0.68

Chemical Structure| 35461-99-5

[ 35461-99-5 ]

3-(Furan-2-yl)benzoic acid

Similarity: 0.68

; ;