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204388-61-4 | Pyrimidine, 1,4,5,6-tetrahydro-5-(3-methyl-5-isoxazolyl)- (9CI)
CAS No: 204388-61-4 Catalog No: AG00CFKX MDL No:
Product Description
Catalog Number:
AG00CFKX
Chemical Name:
Pyrimidine, 1,4,5,6-tetrahydro-5-(3-methyl-5-isoxazolyl)- (9CI)
CAS Number:
204388-61-4
IUPAC Name:
3-methyl-5-(1,4,5,6-tetrahydropyrimidin-5-yl)-1,2-oxazole
InChI:
InChI=1S/C8H11N3O/c1-6-2-8(12-11-6)7-3-9-5-10-4-7/h2,5,7H,3-4H2,1H3,(H,9,10)
InChI Key:
YZWVWXAPPKUOMQ-UHFFFAOYSA-N
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.09g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.196g/mol
Monoisotopic Mass:
165.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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