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181178-92-7 | Pyridine, 3-(3-methyl-4-isoxazolyl)- (9CI)
CAS No: 181178-92-7 Catalog No: AG00BANL MDL No:
Product Description
Catalog Number:
AG00BANL
Chemical Name:
Pyridine, 3-(3-methyl-4-isoxazolyl)- (9CI)
CAS Number:
181178-92-7
IUPAC Name:
3-methyl-4-pyridin-3-yl-1,2-oxazole
InChI:
InChI=1S/C9H8N2O/c1-7-9(6-12-11-7)8-3-2-4-10-5-8/h2-6H,1H3
InChI Key:
XUNCNWCVSKDGGW-UHFFFAOYSA-N
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.064g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.176g/mol
Monoisotopic Mass:
160.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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