(4-Acetamidophenyl)acetic acid

Basic Information

View in Editor

CAS Number

18699-02-0

Molecular Formula

C10H11NO3

Molecular Weight

193.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

165.0 to 170.0 deg-C

Boiling Point

449.1 °C at 760 mmHg

Density

1.288

Flash Point

225.4 °C

Refractive Index

1.604

SMILES

View in Editor

CC(=O)NC1=CC=C(C=C1)CC(=O)O

InChI

InChI=1S/C10H11NO3/c1-7(12)11-9-4-2-8(3-5-9)6-10(13)14/h2-5H,6H2,1H3,(H,11,12)(H,13,14)

InChIKey

MROJXXOCABQVEF-UHFFFAOYSA-N

LogP

1.2721

Topological Polar Surface Area

66.4 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

219

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Toxicity

LD50 in male, female mice, male, female rats (mg/kg): 1.06, 1.30, 1.95, 2.03 i.p.; 5.68, 5.48, 5.48, 6.12 s.c.; 15.3, 14.7, 14.8, 15.4 orally (Toshida)

Synonyms & References

English

MLS000881203
EN300-13165
Actaritum
HMS3393C06
MROJXXOCABQVEF-UHFFFAOYSA-N
NS00026113
CHEBI:31173
2-(4-acetamidophenyl)acetic acid
MS 932
NCGC00255094-01
ACTARIT [JAN]
Mirabegron metabolite M9
AC-1285
AKOS000104755
FT-0630454
2-14-00-00281 (Beilstein Handbook Reference)
AB6003
Orcl
Tox21_301197
AB00172855_13
ACTARIT [MART.]
Mover
[4-(acetylamino)phenyl]acetic acid
YM-340790
(4-acetamino-phenyl)-acetic acid
HMS3715F18
Tox21_111820_1
actarit
4-Acetylaminophenylacetic acid;MS-932
NSC 170317
A935860

MDL Number

MFCD00196165

FAQ

What is (4-Acetamidophenyl)acetic acid (CAS: 18699-02-0)?

(4-Acetamidophenyl)acetic acid, also known as acetaminophenacetic acid, is a chemical compound with the molecular formula C9H11NO3. It is a derivative of acetaminophen and is used in the synthesis of various pharmaceuticals and research reagents. It has a pungent odor and is soluble in water.

What are the main uses of (4-Acetamidophenyl)acetic acid (CAS: 18699-02-0)?

(4-Acetamidophenyl)acetic acid is primarily used in the pharmaceutical industry as an intermediate in the synthesis of acetaminophen and other analgesics. It is also used in research as a reagent for various chemical reactions.

Is (4-Acetamidophenyl)acetic acid (CAS: 18699-02-0) safe?

(4-Acetamidophenyl)acetic acid can be safe when handled with appropriate precautions. However, it is important to follow safety guidelines, including wearing protective clothing and handling it in a well-ventilated area. Exposure to this compound should be minimized to avoid potential health risks.

How should (4-Acetamidophenyl)acetic acid (CAS: 18699-02-0) be stored?

(4-Acetamidophenyl)acetic acid should be stored in a cool, dry place away from direct sunlight and sources of heat. It should be kept in a tightly sealed container to prevent moisture absorption. Proper storage conditions are crucial to maintain its stability and prevent degradation.