4-Chloro-3-methylbenzoic Acid - CAS 7697-29-2

Catalog:	BB035772
Product Name:	4-Chloro-3-methylbenzoic Acid
CAS:	7697-29-2
Synonyms:	4-chloro-3-methylbenzoic acid; 4-chloro-3-methylbenzoic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-chloro-3-methylbenzoic acid
Description:	4-Chloro-3-methylbenzoic Acid (CAS# 7697-29-2) is used as a reactant in the preparation of tipifarnib analogs as cancer drugs agains chagas disease.
Molecular Weight:	170.59
Molecular Formula:	C8H7ClO2
Canonical SMILES:	CC1=C(C=CC(=C1)C(=O)O)Cl
InChI:	InChI=1S/C8H7ClO2/c1-5-4-6(8(10)11)2-3-7(5)9/h2-4H,1H3,(H,10,11)
InChI Key:	MRUKIIWRMSYKML-UHFFFAOYSA-N
Boiling Point:	299 °C at 760 mmHg
Density:	1.31 g/cm³
Appearance:	Pink to beige powder or crystalline powder
MDL:	MFCD00045853
LogP:	2.34660

Publication Number	Title	Priority Date
CN-111972603-A	Selenium-rich buckwheat noodles and preparation method thereof	20200818
JP-2021134343-A	A reactive mixture containing a plurality of reactive components and a polymer having an aryl ether ketone structure obtained from this mixture.	20200227
CN-112441907-A	Method for co-producing mono-substituted methyl benzoic acid and mono-substituted phthalic acid	20190830
CN-108017612-B	Preparation method of canagliflozin intermediate	20171129
WO-2018072707-A1	Aromatic ether derivative, preparation method therefor, and medical applications thereof	20161018

Related Products

Online Inquiry

Name:

* Phone:

* Service & Products of Interested:

Project Description:

* Quantity:

* Email:

* Verification Code:

Customer Support

If the product you need is not in our catalog, please contact us in time to submit your needs. You can help our website get better and better. Why not submit the request today?

Submit Requirement

Customer Centered

Global Delivery

Warehouses in multiple cities to ensure fast delivery

Quality Assurance

Strict process parameter control to ensure product quality

Large Stock

> 20,000 building blocks and intermediates from stock

Process Scale-up

Process scale-up from lab to industrial scale

Flexible Batch Size

Flexible batch size for diverse industrial demands

Related Functional Groups

Carbonyl Compounds

[87-88-7]
Chloranilic acid
[55441-25-3]
1-(2-Cyanophenyl)urea
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[91552-11-3]
2-(3-Chlorophenyl)cyclopropanecarboxylic Acid
[927676-51-5]
2-(6-Bromo-3-indolyl)-2-oxoacetic Acid

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	158
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	170.0134572
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	170.0134572
Rotatable Bond Count:	1
Topological Polar Surface Area:	37.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3