CAS RN: 865706-98-5

methyl amino(hydroxyimino)acetate

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5 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250901 100mg In stock Shanghai Inquiry
Batchno.20250116 1g In stock Shanghai Inquiry
Batchno.20250822 250mg In stock Shanghai Inquiry
Batchno.20251123 5g In stock Shanghai Inquiry
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Batchno.20260514 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS865706-98-5
  • Purity/Analytical Methods: >99.0%
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865706-98-5 / methyl (2Z)-2-amino-2-hydroxyiminoacetate

Standard CAS: 865706-98-5 Multi CAS: Yes

Basic Information

CAS
865706-98-5
Multi CAS
Yes
Molecular Formula
C3H6N2O3
Molecular Weight
118.090000
Exact Mass
118.037842
InChI
InChI=1S/C3H6N2O3/c1-8-3(6)2(4)5-7/h7H,1H3,(H2,4,5)
InChIKey
MCOACEFOXULRHU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
0.33
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
2
Molar refractivity
25.42
TPSA
84.91

LogP / Solubility

WLOGP
-1.09
MLOGP
-0.97
XLogP3
0.2
Consensus LogP
-0.62
Log S (ESOL)
0.12
Class (ESOL)
Highly soluble
Log S (Ali)
0.26
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.48
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)
-4.22

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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