4,5-Dimethyloxazole

CAT: 0127-OR93165-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR93165-01Size:100 mg

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CAS Number

20662-83-3

MDL Number

MFCD11110236

Purity

98%

Smiles

CC1=C(C)OC=N1

Chemical Information

4,5-Dimethyloxazole

4,5-Dimethyloxazole is an oxazole.

CAS Number	20662-83-3
PubChem CID	30214
IUPAC Name	4,5-dimethyl-1,3-oxazole
Molecular Formula	C5H7NO
Molecular Weight	97.12
XLogP	1.1
Topological Polar Surface Area	26
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	7
Formal Charge	0
Complexity	65

SMILES

CC1=C(OC=N1)C

InChI

InChI=1S/C5H7NO/c1-4-5(2)7-3-6-4/h3H,1-2H3

InChIKey

YVORRVFKHZLJGZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 20662-83-3

CID: 30214

Formula: C5H7NO

MW: 97.12

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	97.12
XLogP3	1.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	97.052763847
Monoisotopic Mass	97.052763847
Topological Polar Surface Area	26 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	65.1
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR963593-01	2,4-Dimethyloxazole-5-carboxaldehyde
OR1053400-01	2,4-Dimethyloxazole
OR300682-01	Ethyl 2,4-dimethyloxazole-5-carboxylate
OR955696	Methyl 2,5-dimethyloxazole-4-carboxylate
OR77266-01	2- (3-Bromophenyl) -4,5-dihydro-4,4-dimethyloxazole
OR1092940	2- (2,3-Dimethoxyphenyl) -4,5-dihydro-4,4-dimethyloxazole
OR92572-01	2-[2- (Diphenylphosphino) phenyl]-4,5-dihydro-4,4-dimethyloxazole
OR94867-01	4,5-Dimethyloxazol-2-amine
OR1069415-01	4-Ethynyl-3,5-dimethylisoxazole
OR40198-01	4- (Aminomethyl) -3,5-dimethylisoxazole

Catalog	Name
TN9508-01	4,5-Dimethyloxazole
sc-266095	2,4-Dimethyloxazole-5-carbaldehyde
YAA01211-01	2,5-Dimethyloxazole
sc-274825	2-Ethyl-4,5-dimethyloxazole
GTR19254864-01	2,4-Dimethyloxazole
TRC-B711005-100MG	2-[(4-Bromophenyl)methyl]-4,5-dihydro-4,4-dimethyloxazole
TRC-D490485-25MG	2-(2,5-Dimethoxy-4-methylphenyl)-4,5-dihydro-4,4-dimethyloxazole
B685920	2-(6-Bromo-2-naphthalenyl)-4,5-dihydro-4,4-dimethyloxazole
sc-504198	2- (6-Bromo-2-naphthalenyl) -4,5-dihydro-4,4-dimethyloxazole
019236	4,4,5,5,5-Pentafluoropentanol