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CAS 10160-87-9 Propargylaldehyde Diethyl Acetal molecular structure lightbox
CAS RN: 10160-87-9

Propargylaldehyde Diethyl Acetal

Product Availability

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4 package records1 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250417 100ml Out of stock Inquiry
Batchno.20260403 1ml In stock Inquiry
Batchno.20250629 25ml Out of stock Inquiry
Batchno.20260225 5ml Out of stock Inquiry
  • Product code: SSC-002432
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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, 100g, 25g
  • 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 10160-87-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >97% 5 In Stock Hong Kong Inquiry
10g >97% 5 In Stock Beijing Inquiry
100g >97% 5 In Stock Shenzhen Inquiry
25g >97% 3 In Stock Shenzhen Inquiry

10160-87-9 / 3,3-diethoxyprop-1-yne

3,3-Diethoxypropyne | EINECS 233-430-4 | DTXSID60144050

Standard CAS: 10160-87-9 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
10160-87-9
Multi CAS
Yes
Molecular Formula
C7H12O2
Molecular Weight
128.170000
Exact Mass
128.083730
SMILES
CCOC(C#C)OCC
InChI
InChI=1S/C7H12O2/c1-4-7(8-5-2)9-6-3/h1,7H,5-6H2,2-3H3
InChIKey
RGUXEWWHSQGVRZ-UHFFFAOYSA-N
Synonyms
3,3-Diethoxypropyne EINECS 233-430-4 DTXSID60144050 NSC 45019 RefChem:485249

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
0.71
Rotatable bonds
4
H-bond acceptors
2
Molar refractivity
35.87
TPSA
18.46

LogP / Solubility

WLOGP
1.02
MLOGP
0.89
XLogP3
0.9
Consensus LogP
0.94
Log S (ESOL)
-1.01
Class (ESOL)
Soluble
Log S (Ali)
-1.35
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.82
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)
-2.78

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)
Flammable Irritant
Signal
Warning
GHS Hazard Statements
H226 (98%): Flammable liquid and vapor [Warning Flammable liquids] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (98%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501

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