CAS 1450754-37-6 3-(3-(But-3-yn-1-yl)-3H-diazirin-3-yl)propanoic acid molecular structure

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CAS RN: 1450754-37-6

3-(3-(But-3-yn-1-yl)-3H-diazirin-3-yl)propanoic acid

Product Availability

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10 package records9 with current stock3 grade groups

Grade In stock only

Batch No.	Package	Availability	Warehouse	Inquiry
Batchno.20250718	100mg	In stock	Shanghai, Shenzhen, Wuhan	Inquiry
Batchno.20251015	10mg	In stock	Shanghai	Inquiry
Batchno.20250717	1g	In stock	Shanghai	Inquiry
Batchno.20260513	250mg	In stock	Shanghai, Shenzhen, Tianjin	Inquiry
Batchno.20260406	25mg	In stock	Shanghai	Inquiry
Batchno.20250330	50mg	In stock	Shanghai, Shenzhen, Tianjin	Inquiry

Batch No.	Package	Availability	Warehouse	Lead Time	Inquiry
Batchno.20250224	100mg	In stock	Shanghai, Guangdong		Inquiry
Batchno.20250706	25mg	In stock	Shanghai, Shandong, Guangdong		Inquiry

Batch No.	Package	Availability	Warehouse	Lead Time	Inquiry
Batchno.20250904	100mg	In stock	Shanghai		Inquiry
Batchno.20251116	25mg	Out of stock		8-10 business days	Inquiry

Product code: SSC-056439

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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: 1g, 0.1g, 5g, 0.25g
Available purity: 98.00-102.00%
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 1450754-37-6
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
1g	98.00-102.00%	2 In Stock	Shanghai	Inquiry
0.1g	98.00-102.00%	1 In Stock	Shanghai	Inquiry
5g	98.00-102.00%	1 In Stock	Shenzhen	Inquiry
0.25g	98.00-102.00%	0 Out of Stock	Shanghai	Inquiry

1450754-37-6 / 3-(3-but-3-ynyldiazirin-3-yl)propanoic acid

Standard CAS: 1450754-37-6 Multi CAS: No

Basic Information Computed Properties Safety & Transport

Basic Information

CAS

1450754-37-6

Multi CAS

Molecular Formula

C8H10N2O2

Molecular Weight

166.180000

Exact Mass

166.074228

SMILES

C#CCCC1(N=N1)CCC(=O)O

InChI

InChI=1S/C8H10N2O2/c1-2-3-5-8(9-10-8)6-4-7(11)12/h1H,3-6H2,(H,11,12)

InChIKey

JRNSKSYASHYNCM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count

Fraction Csp3

0.62

Rotatable bonds

H-bond acceptors

H-bond donors

Molar refractivity

42.52

TPSA

62.02

LogP / Solubility

WLOGP

1.43

MLOGP

1.25

XLogP3

0.9

Consensus LogP

1.19

Log S (ESOL)

-1.44

Class (ESOL)

Soluble

Log S (Ali)

-1.95

Class (Ali)

Soluble

Log S (SILICOS-IT)

-2.52

Class (SILICOS-IT)

Moderately soluble

ADME

GI absorption

High

BBB permeant

Yes

P-gp substrate

CYP1A2 inhibitor

CYP2C19 inhibitor

CYP2C9 inhibitor

CYP2D6 inhibitor

CYP3A4 inhibitor

Log Kp (skin permeation)

-2.72

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Veber

Yes

Egan

Yes

Muegge

Bioavailability score

0.55

Brenk alerts

Leadlikeness

Synthetic Accessibility

1.5

Safety & Transport

Pictogram(s)

Corrosive

Signal

Danger

GHS Hazard Statements

H314 (66.7%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

Precautionary Statement Codes

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501

Applications of CAS 1450754-37-6

This compound is commonly used in general chemistry research and laboratory applications. Starshine Chemical supplies CAS 1450754-37-6 for R&D and pilot-scale use, with flexible pack sizes and purity grades available.

Storage & Handling

Storage: Keep the container tightly closed in a cool, dry and well-ventilated place. For detailed hazard, storage and transport information, request the SDS (Safety Data Sheet) with your inquiry.

Quotation & Packaging

Prices are confirmed by inquiry. Request a quote for current pricing, minimum order quantity (MOQ) and lead time. The pack sizes listed on this page are reference options; custom pack sizes and bulk quantities are available on request.

Quality & Compliance

Specifications and purity shown on this page are based on batch records. A Certificate of Analysis (COA) is available on request. For research and further manufacturing use only — not for direct human or therapeutic use.