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CAS 141942-85-0 Ethyl (R)-(-)-4-Cyano-3-hydroxybutyrate molecular structure lightbox
CAS RN: 141942-85-0

Ethyl (R)-(-)-4-Cyano-3-hydroxybutyrate

Product Availability

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2 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250326 25g Out of stock 8-10 business days Inquiry
Batchno.20251111 5g In stock Shanghai, Shandong Inquiry
  • Product code: SSC-052641
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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: 10g, 25g, 5g, 100g, 500g
  • Available purity: >97%
  • Inventory rows with stock: 3
  • 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 141942-85-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g >97% 5 In Stock Beijing Inquiry
25g >97% 4 In Stock Shenzhen Inquiry
5g >97% 2 In Stock Shanghai Inquiry
100g >97% 0 Out of Stock Shenzhen Inquiry
500g >97% 0 Out of Stock Hong Kong Inquiry

141942-85-0 / ethyl (3R)-4-cyano-3-hydroxybutanoate

Standard CAS: 141942-85-0 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
141942-85-0
Multi CAS
No
Molecular Formula
C7H11NO3
Molecular Weight
157.170000
Exact Mass
157.073893
SMILES
CCOC(=O)C[C@@H](CC#N)O
InChI
InChI=1S/C7H11NO3/c1-2-11-7(10)5-6(9)3-4-8/h6,9H,2-3,5H2,1H3/t6-/m1/s1
InChIKey
LOQFROBMBSKWQY-ZCFIWIBFSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.71
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
1
Molar refractivity
37.49
TPSA
70.32

LogP / Solubility

WLOGP
0.21
MLOGP
0.18
XLogP3
-0.5
Consensus LogP
-0.04
Log S (ESOL)
-0.69
Class (ESOL)
Very soluble
Log S (Ali)
-1
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.34
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)
-3.53

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H319: Causes serious eye irritation [Warning Serious eye damage/eye irritation] H315 (79.2%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (79.2%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P264+P265, P280, P305+P351+P338, and P337+P317 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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