[email protected]
CAS 7001-18-5 METHYL 2-METHOXYACRYLATE molecular structure lightbox
CAS RN: 7001-18-5

METHYL 2-METHOXYACRYLATE

Product Availability

Choose a grade to view its available package options.

1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250311 500mg In stock Shanghai Inquiry
  • Product code: starshine_CAS7001-18-5
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

7001-18-5 / methyl 2-methoxyprop-2-enoate

Standard CAS: 7001-18-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
7001-18-5
Multi CAS
Yes
Molecular Formula
C5H8O3
Molecular Weight
116.110000
Exact Mass
116.047344
InChI
InChI=1S/C5H8O3/c1-4(7-2)5(6)8-3/h1H2,2-3H3
InChIKey
BTTXESIFAHCXMK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
0.4
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
28.16
TPSA
35.53

LogP / Solubility

WLOGP
0.32
MLOGP
0.27
XLogP3
0.9
Consensus LogP
0.5
Log S (ESOL)
-0.63
Class (ESOL)
Very soluble
Log S (Ali)
-0.74
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.92
Class (SILICOS-IT)
Very 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)
-3.2

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

Get In Touch

Contact Us