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CAS 5835-28-9 2-((2-Hydroxyethyl)amino)acetic acid molecular structure lightbox
CAS RN: 5835-28-9

2-((2-Hydroxyethyl)amino)acetic acid

  • Product code: SSC-166595
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 5835-28-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

5835-28-9 / 2-(2-hydroxyethylamino)acetic acid

Standard CAS: 5835-28-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
5835-28-9
Multi CAS
Yes
Molecular Formula
C4H9NO3
Molecular Weight
119.120000
Exact Mass
119.058243
InChI
InChI=1S/C4H9NO3/c6-2-1-5-3-4(7)8/h5-6H,1-3H2,(H,7,8)
InChIKey
FOUZISDNESEYLX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
0.75
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
3
Molar refractivity
27.59
TPSA
69.56

LogP / Solubility

WLOGP
-1.35
MLOGP
-1.2
XLogP3
-3.6
Consensus LogP
-2.05
Log S (ESOL)
0.53
Class (ESOL)
Highly soluble
Log S (Ali)
0.44
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.2
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
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)
-4.4

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

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