2-Chloro-3-nitrotoluene - CAS 3970-40-9

Name: 2-Chloro-3-nitrotoluene
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB024090
Product Name:	2-Chloro-3-nitrotoluene
CAS:	3970-40-9
Synonyms:	2-chloro-1-methyl-3-nitrobenzene

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-chloro-1-methyl-3-nitrobenzene
Description:	2-Chloro-3-nitrotoluene (CAS# 3970-40-9) is a useful research chemical.
Molecular Weight:	171.58
Molecular Formula:	C7H6ClNO2
Canonical SMILES:	CC1=C(C(=CC=C1)[N+](=O)[O-])Cl
InChI:	InChI=1S/C7H6ClNO2/c1-5-3-2-4-6(7(5)8)9(10)11/h2-4H,1H3
InChI Key:	XTSGZXRUCAWXKY-UHFFFAOYSA-N
Boiling Point:	147 °C (25 mmHg)
Melting Point:	21 °C
Purity:	95 %
Density:	1.298 g/cm³
Appearance:	Colorless to yellow liquid
MDL:	MFCD00134653
LogP:	3.07980

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

Nitrogen Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[32894-07-8]C9H11NS · HCl
Benzyl thioacetimidate hydrochloride
[937273-31-9]C12H14ClNO4
2-[(Allyloxy)methyl]-1-(2-chloroethoxy)-4-nitrobenzene
[333311-69-6]C12H12BrN3O2
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[1281984-38-0]C8H10N4O4
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[1243387-55-4]C10H8F3NO3
1-Cyclopropoxy-3-nitro-5-(trifluoromethyl)benzene

GHS Hazard Statement:	H302 (95%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P273, P301+P312, P330, P391, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-113024384-A	Synthesis method of 2-fluoro-3-nitrobenzoic acid intermediate raw material	20210316
CN-111909108-A	Biphenyl compound and preparation method and medical application thereof	20190902
WO-2021043116-A1	Biphenyl compounds, preparation method therefor and medical use thereof	20190902
EP-3594199-A1	Crystalline 2-fluoro-3-nitrotoluene and process for the preparation thereof	20180709
EP-3594199-B1	Crystalline 2-fluoro-3-nitrotoluene and process for the preparation thereof	20180709

Complexity:	157
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	171.0087061
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	171.0087061
Rotatable Bond Count:	0
Topological Polar Surface Area:	45.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7