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CAS 16115-80-3 DIMETHYL AMINOMALONATE HYDROCHLORIDE molecular structure lightbox
CAS RN: 16115-80-3

DIMETHYL AMINOMALONATE HYDROCHLORIDE

Product Availability

Choose a grade to view its available package options.

7 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250324 1g In stock Inquiry
Batchno.20260127 25g In stock Inquiry
Batchno.20251124 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260512 100g In stock Shanghai Inquiry
Batchno.20250306 10g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20260524 25g In stock Shanghai Inquiry
Batchno.20251014 5g In stock Shanghai, Shenzhen Inquiry
  • Product code: SSC-068880
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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, 1g
  • Available purity: >97%
  • Inventory rows with stock: 4
  • 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 16115-80-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >97% 5 In Stock Hong Kong Inquiry
10g >97% 5 In Stock Shanghai Inquiry
25g >97% 5 In Stock Hong Kong Inquiry
100g >97% 2 In Stock Hong Kong Inquiry
1g >97% 0 Out of Stock Beijing Inquiry

16115-80-3 / dimethyl 2-aminopropanedioate

Standard CAS: 16115-80-3 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
16115-80-3
Multi CAS
No
Molecular Formula
C5H9NO4
Molecular Weight
147.130000
Exact Mass
147.053158
SMILES
COC(=O)C(C(=O)OC)N
InChI
InChI=1S/C5H9NO4.ClH/c1-9-4(7)3(6)5(8)10-2;/h3H,6H2,1-2H3;1H
InChIKey
QWNDKNJSEWOEDM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.6
Rotatable bonds
2
H-bond acceptors
5
H-bond donors
1
Molar refractivity
32.01
TPSA
78.62

LogP / Solubility

WLOGP
-1.34
MLOGP
-1.19
XLogP3
-0.7
Consensus LogP
-1.08
Log S (ESOL)
0.22
Class (ESOL)
Highly soluble
Log S (Ali)
0.2
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.26
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)
-4.57

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 (100%): 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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