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878812-24-9 | Oxazole, 4,5-dihydro-2-[1-(iodomethyl)cyclopropyl]-4,4-dimethyl-
CAS No: 878812-24-9 Catalog No: AG004E7E MDL No:
Product Description
Catalog Number:
AG004E7E
Chemical Name:
Oxazole, 4,5-dihydro-2-[1-(iodomethyl)cyclopropyl]-4,4-dimethyl-
CAS Number:
878812-24-9
Molecular Formula:
C9H14INO
Molecular Weight:
279.1180
IUPAC Name:
2-[1-(iodomethyl)cyclopropyl]-4,4-dimethyl-5H-1,3-oxazole
InChI:
InChI=1S/C9H14INO/c1-8(2)6-12-7(11-8)9(5-10)3-4-9/h3-6H2,1-2H3
InChI Key:
IDKOUNJVBFLAPY-UHFFFAOYSA-N
SMILES:
ICC1(CC1)C1=NC(CO1)(C)C
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.012g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.121g/mol
Monoisotopic Mass:
279.012g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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