CAS 10098-39-2 4-nitrophenylglycolic acid molecular structure

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CAS RN: 10098-39-2

4-nitrophenylglycolic acid

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1 package records0 with current stock1 grade group

Grade In stock only

Batch No.	Package	Availability	Lead Time	Inquiry
Batchno.20250930	100mg / 250mg / 1g	Out of stock	8-10 business days	Inquiry

Product code: SSC-001773

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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, 0.25g, 5g, 10g, 25g
Available purity: ≥95%
Inventory rows with stock: 5
Bulk packaging: confirmed by inquiry

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Available Pack Sizes & Stock

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Recorded sizes, purity and stock details for CAS 10098-39-2
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
1g	≥95%	4 In Stock	Hong Kong	Inquiry
0.1g	≥95%	2 In Stock	Beijing	Inquiry
0.25g	≥95%	2 In Stock	Shenzhen	Inquiry
5g	≥95%	1 In Stock	Shenzhen	Inquiry
10g	≥95%	1 In Stock	Shenzhen	Inquiry
25g	≥95%	0 Out of Stock	Shenzhen	Inquiry

10098-39-2 / 2-hydroxy-2-(4-nitrophenyl)acetic acid

p-nitromandelic acid | RefChem:928465 | 2-hydroxy-2-(4-nitrophenyl)acetic acid

Standard CAS: 10098-39-2 Multi CAS: Yes

Basic Information Computed Properties

Basic Information

CAS

10098-39-2

Multi CAS

Yes

Molecular Formula

C8H7NO5

Molecular Weight

197.140000

Exact Mass

197.032422

SMILES

C1=CC(=CC=C1C(C(=O)O)O)[N+](=O)[O-]

InChI

InChI=1S/C8H7NO5/c10-7(8(11)12)5-1-3-6(4-2-5)9(13)14/h1-4,7,10H,(H,11,12)

InChIKey

ZSMJZVLXJDNZHG-UHFFFAOYSA-N

Synonyms

p-nitromandelic acid RefChem:928465 2-hydroxy-2-(4-nitrophenyl)acetic acid 4-Nitrophenylglycolic acid MFCD04971202

Computed Properties

Structural Parameters

Heavy atom count

Aromatic heavy atom count

Fraction Csp3

0.12

Rotatable bonds

H-bond acceptors

H-bond donors

Molar refractivity

45.69

TPSA

100.67

LogP / Solubility

WLOGP

0.71

MLOGP

0.63

XLogP3

0.4

Consensus LogP

0.58

Log S (ESOL)

-1.63

Class (ESOL)

Soluble

Log S (Ali)

-1.69

Class (Ali)

Soluble

Log S (SILICOS-IT)

-1.89

Class (SILICOS-IT)

Soluble

ADME

GI absorption

High

BBB permeant

P-gp substrate

CYP1A2 inhibitor

CYP2C19 inhibitor

CYP2C9 inhibitor

CYP2D6 inhibitor

CYP3A4 inhibitor

Log Kp (skin permeation)

-3.42

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Veber

Yes

Egan

Yes

Muegge

Bioavailability score

0.55

Brenk alerts

Leadlikeness

Synthetic Accessibility

Applications of CAS 10098-39-2

This compound is commonly used in general chemistry research and laboratory applications. Starshine Chemical supplies CAS 10098-39-2 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.