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CAS 10489-74-4 Ethyl 2-amino-2-(hydroxyimino)acetate molecular structure lightbox
CAS RN: 10489-74-4

Ethyl 2-amino-2-(hydroxyimino)acetate

  • Product code: SSC-006610
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 5g, 10g, 25g, 100g
  • Available purity: ≥98%
  • Inventory rows with stock: 2
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 10489-74-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥98% 5 In Stock Shanghai Inquiry
5g ≥98% 1 In Stock Beijing Inquiry
10g ≥98% 0 Out of Stock Shenzhen Inquiry
25g ≥98% 0 Out of Stock Shenzhen Inquiry
100g ≥98% 0 Out of Stock Beijing Inquiry

10489-74-4 / ethyl (2Z)-2-amino-2-hydroxyiminoacetate

Ethyl 2-oximinooxamate | DTXSID40430645 | RefChem:342925

Standard CAS: 10489-74-4 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
10489-74-4
Multi CAS
Yes
Molecular Formula
C4H8N2O3
Molecular Weight
132.120000
Exact Mass
132.053492
SMILES
CCOC(=O)/C(=N/O)/N
InChI
InChI=1S/C4H8N2O3/c1-2-9-4(7)3(5)6-8/h8H,2H2,1H3,(H2,5,6)
InChIKey
QGYKRMZPOOILBA-UHFFFAOYSA-N
Synonyms
Ethyl 2-oximinooxamate DTXSID40430645 RefChem:342925 DTXCID10381478 626-986-8

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
0.5
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
30.04
TPSA
84.91

LogP / Solubility

WLOGP
-0.7
MLOGP
-0.63
XLogP3
0.6
Consensus LogP
-0.24
Log S (ESOL)
-0.15
Class (ESOL)
Very soluble
Log S (Ali)
-0.14
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.05
Class (SILICOS-IT)
Very 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)
-4.03

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (97.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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