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CAS 69630-50-8 D-ASPARTIC ACID DIMETHYL ESTER HYDROCHLORIDE molecular structure lightbox
CAS RN: 69630-50-8

D-ASPARTIC ACID DIMETHYL ESTER HYDROCHLORIDE

Product Availability

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6 package records6 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250224 100g In stock Inquiry
Batchno.20250916 10g In stock Inquiry
Batchno.20260119 1g In stock Inquiry
Batchno.20250127 25g In stock Inquiry
Batchno.20250414 500g In stock Inquiry
Batchno.20260406 5g In stock Inquiry
  • Product code: SSC-179347
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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: 5g, 10g, 25g, 100g
  • Available purity: ≥98%
  • Inventory rows with stock: 1
  • 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 69630-50-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥98% 5 In Stock Hong Kong Inquiry
10g ≥98% 0 Out of Stock Shenzhen Inquiry
25g ≥98% 0 Out of Stock Shenzhen Inquiry
100g ≥98% 0 Out of Stock Shanghai Inquiry

69630-50-8 / dimethyl 2-aminobutanedioate;hydrochloride

Standard CAS: 69630-50-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
69630-50-8
Multi CAS
Yes
Molecular Formula
C6H12CLNO4
Molecular Weight
197.620000
Exact Mass
197.045486
InChI
InChI=1S/C6H11NO4.ClH/c1-10-5(8)3-4(7)6(9)11-2;/h4H,3,7H2,1-2H3;1H/t4-;/m1./s1
InChIKey
PNLXWGDXZOYUKB-PGMHMLKASA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
0.67
Rotatable bonds
3
H-bond acceptors
5
H-bond donors
1
Molar refractivity
43.87
TPSA
78.62

LogP / Solubility

WLOGP
-0.53
MLOGP
-0.47
XLogP3
-0.53
Consensus LogP
-0.51
Log S (ESOL)
-0.53
Class (ESOL)
Very soluble
Log S (Ali)
-0.8
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.87
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
Low
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)
-4.3

Drug-likeness / Medicinal Chemistry

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

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