.gif)
CAS RN: 34159-46-1
DIMETHYLPHOSPHONOACETIC ACID
Product Availability
Choose a grade to view its available package options.
4 package records4 with current stock1 grade group
- Product code: starshine_CAS34159-46-1
- Purity/Analytical Methods: >99.0%
34159-46-1 / 2-dimethoxyphosphorylacetic acid
Basic Information
CAS
34159-46-1
Multi CAS
Yes
Molecular Formula
C4H9O5P
Molecular Weight
168.080000
Exact Mass
168.018760
InChI
InChI=1S/C4H9O5P/c1-8-10(7,9-2)3-4(5)6/h3H2,1-2H3,(H,5,6)
InChIKey
QOJLTIJRCYTUDQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
0.75
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
1
Molar refractivity
34.13
TPSA
72.83
LogP / Solubility
WLOGP
0.56
MLOGP
0.49
XLogP3
-0.9
Consensus LogP
0.05
Log S (ESOL)
-0.97
Class (ESOL)
Very soluble
Log S (Ali)
-1.34
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.69
Class (SILICOS-IT)
Soluble
ADME
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)
-3.35
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
FIPEXIDE HYDROCHLORIDE
- CAS RN: 34161-23-4
- Product Code: starshine_CAS34161-23-4
- Purity/Analytical method: >99.0%
-
1-(2-[4-Chlorophenoxy]acetyl)-4-(3,4-methylenedioxybenzyl)piperazine
- CAS RN: 34161-24-5
- Product Code: starshine_CAS34161-24-5
- Purity/Analytical method: >99.0%
-
2-CHLORO-N-[2-(3-METHOXYPHENYL)ETHYL]-ACETAMIDE
- CAS RN: 34162-12-4
- Product Code: SSC-140397
-
IMidazo[1,2-a]pyridin-3-aMine, 7-Methyl-
- CAS RN: 34164-98-2
- Product Code: starshine_CAS34164-98-2
- Purity/Analytical method: >99.0%
-
-
.gif)
![CAS 34161-24-5 1-(2-[4-Chlorophenoxy]acetyl)-4-(3,4-methylenedioxybenzyl)piperazine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/34161-24-5(2).gif)
![CAS 34162-12-4 2-CHLORO-N-[2-(3-METHOXYPHENYL)ETHYL]-ACETAMIDE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/34162-12-4(2).gif)
![CAS 34164-98-2 IMidazo[1,2-a]pyridin-3-aMine, 7-Methyl- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/34164-98-2(2).gif)
![CAS 34165-08-7 3-nitro-5-methylimidazo[1,2-a]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/34165-08-7(2).gif)
![CAS 34165-09-8 2-METHYL-3-NITROIMIDAZO[1,2-A]PYRIDINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/34165-09-8(2).gif)