CAS 62129-39-9 (S)-N-BOC-4-Bromophenylalanine molecular structure

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CAS RN: 62129-39-9

(S)-N-BOC-4-Bromophenylalanine

Product Availability

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3 package records3 with current stock1 grade group

Grade In stock only

Batch No.	Package	Availability	Warehouse	Inquiry
Batchno.20260425	1g	In stock	Shandong	Inquiry
Batchno.20260424	25g	In stock	Shanghai	Inquiry
Batchno.20250727	5g	In stock	Shanghai, Shandong	Inquiry

Product code: SSC-171195

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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, 500g
Available purity: >98%
Inventory rows with stock: 5
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 62129-39-9
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
5g	>98%	5 In Stock	Beijing	Inquiry
10g	>98%	5 In Stock	Hong Kong	Inquiry
25g	>98%	5 In Stock	Shanghai	Inquiry
100g	>98%	5 In Stock	Shenzhen	Inquiry
1g	>98%	2 In Stock	Hong Kong	Inquiry
500g	>98%	0 Out of Stock	Hong Kong	Inquiry

62129-39-9 / (2S)-3-(4-bromophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Standard CAS: 62129-39-9 Multi CAS: Yes

Basic Information Computed Properties

Basic Information

CAS

62129-39-9

Multi CAS

Yes

Molecular Formula

BC14H18O4Rn

Molecular Weight

344.200000

Exact Mass

343.041920

InChI

InChI=1S/C14H18BrNO4/c1-14(2,3)20-13(19)16-11(12(17)18)8-9-4-6-10(15)7-5-9/h4-7,11H,8H2,1-3H3,(H,16,19)(H,17,18)/t11-/m0/s1

InChIKey

ULNOXUAEIPUJMK-NSHDSACASA-N

Computed Properties

Structural Parameters

Heavy atom count

Aromatic heavy atom count

Fraction Csp3

0.43

Rotatable bonds

H-bond acceptors

H-bond donors

Molar refractivity

78.64

TPSA

75.63

LogP / Solubility

WLOGP

2.97

MLOGP

2.63

XLogP3

2.5

Consensus LogP

2.7

Log S (ESOL)

-3.8

Class (ESOL)

Poorly soluble

Log S (Ali)

-4.53

Class (Ali)

Slightly soluble

Log S (SILICOS-IT)

-4.84

Class (SILICOS-IT)

Slightly soluble

ADME

GI absorption

High

BBB permeant

Yes

P-gp substrate

CYP1A2 inhibitor

CYP2C19 inhibitor

CYP2C9 inhibitor

Yes

CYP2D6 inhibitor

Yes

CYP3A4 inhibitor

Log Kp (skin permeation)

-2.71

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Yes

Veber

Yes

Egan

Yes

Muegge

Yes

Bioavailability score

0.55

Leadlikeness

Yes

Synthetic Accessibility

Applications of CAS 62129-39-9

This compound is commonly used in general chemistry research and laboratory applications. Starshine Chemical supplies CAS 62129-39-9 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.