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157555-79-8 | Isoxazole, 3-methyl-5-(2-methyl-5-oxazolyl)- (9CI)
CAS No: 157555-79-8 Catalog No: AG00B3Z7 MDL No:
Product Description
Catalog Number:
AG00B3Z7
Chemical Name:
Isoxazole, 3-methyl-5-(2-methyl-5-oxazolyl)- (9CI)
CAS Number:
157555-79-8
IUPAC Name:
2-methyl-5-(3-methyl-1,2-oxazol-5-yl)-1,3-oxazole
InChI:
InChI=1S/C8H8N2O2/c1-5-3-7(12-10-5)8-4-9-6(2)11-8/h3-4H,1-2H3
InChI Key:
VWBIQQORAMBACL-UHFFFAOYSA-N
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.059g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.164g/mol
Monoisotopic Mass:
164.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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