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CAS 39217-38-4 2-amino-3-chloro-propanoic acid molecular structure lightbox
CAS RN: 39217-38-4

2-amino-3-chloro-propanoic acid

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260103 1g / 5g / 25g Out of stock 5-7 business days Inquiry
  • Product code: SSC-146888
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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: ≥95%
  • 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 39217-38-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

39217-38-4 / 2-amino-3-chloropropanoic acid

Standard CAS: 39217-38-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
39217-38-4
Multi CAS
Yes
Molecular Formula
C3H6CLNO2
Molecular Weight
123.540000
Exact Mass
123.008706
InChI
InChI=1S/C3H6ClNO2/c4-1-2(5)3(6)7/h2H,1,5H2,(H,6,7)/t2-/m1/s1
InChIKey
ASBJGPTTYPEMLP-UWTATZPHSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
0.67
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
26.33
TPSA
63.32

LogP / Solubility

WLOGP
-0.36
MLOGP
-0.33
XLogP3
-2.8
Consensus LogP
-1.16
Log S (ESOL)
-0.25
Class (ESOL)
Very soluble
Log S (Ali)
-0.31
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.4
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)
-3.73

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
2

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