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898759-00-7 | 2-(6-OXOHEPTANOYL)OXAZOLE
CAS No: 898759-00-7 Catalog No: AG00GWFQ MDL No:
Product Description
Catalog Number:
AG00GWFQ
Chemical Name:
2-(6-OXOHEPTANOYL)OXAZOLE
CAS Number:
898759-00-7
IUPAC Name:
1-(1,3-oxazol-2-yl)heptane-1,6-dione
InChI:
InChI=1S/C10H13NO3/c1-8(12)4-2-3-5-9(13)10-11-6-7-14-10/h6-7H,2-5H2,1H3
InChI Key:
SGAUMJBNQNYVAY-UHFFFAOYSA-N
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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