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CAS 112018-26-5 (R)-Diethyl 2-aminosuccinate hydrochloride molecular structure lightbox
CAS RN: 112018-26-5

(R)-Diethyl 2-aminosuccinate hydrochloride

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250115 100g In stock Inquiry
Batchno.20250119 1g In stock Inquiry
Batchno.20260614 25g In stock Inquiry
Batchno.20260611 5g In stock Inquiry
  • Product code: SSC-012548
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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: 10g
  • 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 112018-26-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥95% 0 Out of Stock Hong Kong Inquiry

112018-26-5 / diethyl (2R)-2-aminobutanedioate;hydrochloride

DTXSID80497272 | Diethyl D-aspartate--hydrogen chloride (1/1) | RefChem:337975

Standard CAS: 112018-26-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
112018-26-5
Multi CAS
Yes
Molecular Formula
C8H16ClNO4
Molecular Weight
225.670000
Exact Mass
225.076786
SMILES
CCOC(=O)C[C@H](C(=O)OCC)N.Cl
InChI
InChI=1S/C8H15NO4.ClH/c1-3-12-7(10)5-6(9)8(11)13-4-2;/h6H,3-5,9H2,1-2H3;1H/t6-;/m1./s1
InChIKey
AJOXZAAREAYBQR-FYZOBXCZSA-N
Synonyms
DTXSID80497272 Diethyl D-aspartate--hydrogen chloride (1/1) RefChem:337975 DTXCID80448082 (R)-Diethyl 2-aminosuccinate hydrochloride

Computed Properties

Structural Parameters

Heavy atom count
14
Fraction Csp3
0.75
Rotatable bonds
5
H-bond acceptors
5
H-bond donors
1
Molar refractivity
53.11
TPSA
78.62

LogP / Solubility

WLOGP
0.25
MLOGP
0.22
XLogP3
0.25
Consensus LogP
0.24
Log S (ESOL)
-1.07
Class (ESOL)
Soluble
Log S (Ali)
-1.59
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.94
Class (SILICOS-IT)
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)
-3.92

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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