2-Methylnaphtho[1,2-d][1,3]oxazole

Basic Information

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CAS Number

85-15-4

Molecular Formula

C12H9NO

Molecular Weight

183.21 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

-15 ºC

Boiling Point

300°C

Density

1.182

Flash Point

131.1 °C

Refractive Index

1.634

SMILES

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CC1=NC2=C(O1)C=CC3=CC=CC=C32

InChI

InChI=1S/C12H9NO/c1-8-13-12-10-5-3-2-4-9(10)6-7-11(12)14-8/h2-7H,1H3

InChIKey

JCTNVNANPZAULC-UHFFFAOYSA-N

LogP

3.2894200000000016

Topological Polar Surface Area

26.03 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

218

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H318 Causes serious eye damage
Serious eye damage/eye irritation

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

Synonyms & References

English

AKOS000546921
Naphth[1,2-d]oxazole, 2-methyl-
JCTNVNANPZAULC-UHFFFAOYSA-
CCG-19816
2-methylnaphtho[1,2-d]oxazol
InChI=1/C12H9NO/c1-8-13-12-10-5-3-2-4-9(10)6-7-11(12)14-8/h2-7H,1H3
2-Methylnaphth(1,2-d)oxazole
A923562
2-Methylnaphtho[1,2-d]oxazole
DTXSID50883264
AC-19518
MFCD00051328
2-methylbenzo[e][1,3]benzoxazole
FT-0608335
JCTNVNANPZAULC-UHFFFAOYSA-N
2-Methylnaphtho(1,2-d)oxazole
EINECS 201-589-9
D91477
85-15-4
2-Methylnaphthyl[1,2-d]oxazole
Naphth(1,2-d)oxazole, 2-methyl-
2-methylnaphtho[1,2-d][1,3]oxazole
2-Methylnaphth[1,2-d]oxazole
SCHEMBL132481
2-methyl-naphth[1,2-d]oxazole
CS-0456305
2-methylnaphthoxazole
2-Methylnaphtho[1,2d]oxazole
2-Methyl-4,5-benzobenzoxazole
2-methylbenzo[e]benzoxazole
KM2289

MDL Number

MFCD00051328

Customs Code

2934999090

FAQ

What regulatory guidelines apply to 2-Methylnaphtho[1,2-d][1,3]oxazole (CAS: 85-15-4)?

2-Methylnaphtho[1,2-d][1,3]oxazole (CAS: 85-15-4) is regulated under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH (Registration, Evaluation, Authorization, and Restriction of Chemicals) in the European Union, and FDA/EPA requirements for chemical use and disposal. Specific handling, storage, and disposal guidelines must be followed depending on the local regulations and the intended use of the compound.

Are there alternatives to 2-Methylnaphtho[1,2-d][1,3]oxazole (CAS: 85-15-4) in synthesis?

Alternative reagents to 2-Methylnaphtho[1,2-d][1,3]oxazole (CAS: 85-15-4) include various oxazines and oxazoles, such as thiazole and imidazole derivatives. These can be used as alternatives in synthesis depending on the specific reaction conditions and desired product properties.

What is the market or research trend for 2-Methylnaphtho[1,2-d][1,3]oxazole (CAS: 85-15-4)?

The market for 2-Methylnaphtho[1,2-d][1,3]oxazole (CAS: 85-15-4) is growing due to its applications in pharmaceuticals, agrochemicals, and pigments. Research trends indicate increasing interest in its use as a scaffold for drug discovery and in developing novel materials. However, market trends also reflect a shift towards more sustainable and less toxic alternatives.

How should waste containing 2-Methylnaphtho[1,2-d][1,3]oxazole (CAS: 85-15-4) be handled?

Waste containing 2-Methylnaphtho[1,2-d][1,3]oxazole (CAS: 85-15-4) should be collected in appropriate containers and stored separately to prevent contamination. It should be incinerated or disposed of through a professional hazardous waste disposal service. Environmental precautions include proper containment to prevent leaching into the environment and adherence to local hazardous waste regulations.