3,4-Dimethyl-1,2,5-oxadiazole - CAS 4975-21-7

Name: 3,4-Dimethyl-1,2,5-oxadiazole
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB026816
Product Name:	3,4-Dimethyl-1,2,5-oxadiazole
CAS:	4975-21-7
Synonyms:	3,4-dimethyl-1,2,5-oxadiazole; 3,4-dimethyl-1,2,5-oxadiazole

Technical Data

Patents

Computed Properties

IUPAC Name:	3,4-dimethyl-1,2,5-oxadiazole
Description:	3,4-Dimethyl-1,2,5-oxadiazole (CAS# 4975-21-7) is a useful research chemical.
Molecular Weight:	98.10
Molecular Formula:	C4H6N2O
Canonical SMILES:	CC1=NON=C1C
InChI:	InChI=1S/C4H6N2O/c1-3-4(2)6-7-5-3/h1-2H3
InChI Key:	JKJSZGJVBAWEFB-UHFFFAOYSA-N
Boiling Point:	132.9 °C at 760 mmHg
Density:	1.075 g/cm³
Appearance:	Liquid
MDL:	MFCD00020815
LogP:	0.68640

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Related Functional Groups

Oxadiazole/Thiadiazole

[1170802-11-5]C9H9ClN4O3
Ethyl 3-((4-chloro-1H-pyrazol-1-yl)methyl)-1,2,4-oxadiazole-5-carboxylate
[956263-70-0]C9H9IN4O3
Ethyl 3-((4-Iodo-1H-Pyrazol-1-Yl)Methyl)-1,2,4-Oxadiazole-5-Carboxylate
[1172750-87-6]C14H15F3N4O3
Ethyl 3-(2-(5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl)ethyl)-1,2,4-oxadiazole-5-carboxylate
[1018125-37-5]C11H9FN2O3
Ethyl 3-(2-fluorophenyl)-1,2,4-oxadiazole-5-carboxylate
[261626-93-1]C9H8N2O3S
Ethyl 3-(2-thienyl)-1,2,4-oxadiazole-5-carboxylate
[956729-63-8]C9H9N5O5
Ethyl 3-[(3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxylate

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Publication Number	Title	Priority Date
CN-110724276-A	Preparation method of acid-alkali difunctional MOFs material and method for synthesizing 3, 4-dimethylfurazan by using acid-alkali difunctional MOFs material as catalyst	20191028
CN-110724276-B	Preparation method of acid-alkali difunctional MOFs material and method for synthesizing 3, 4-dimethylfurazan by using acid-alkali difunctional MOFs material as catalyst	20191028
CN-108101899-A	The preparation method of IDO1 inhibitor Epacadostat intermediates	20180211
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Complexity:	58.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	98.048012819
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	98.048012819
Rotatable Bond Count:	0
Topological Polar Surface Area:	38.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.7