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918522-86-8 | Oxazole, 2-[1-(1,1-dimethylethyl)cyclopropyl]-4,5-dihydro-4,4-dimethyl-
CAS No: 918522-86-8 Catalog No: AG006PQR MDL No:
Product Description
Catalog Number:
AG006PQR
Chemical Name:
Oxazole, 2-[1-(1,1-dimethylethyl)cyclopropyl]-4,5-dihydro-4,4-dimethyl-
CAS Number:
918522-86-8
Molecular Formula:
C12H21NO
Molecular Weight:
195.3012
IUPAC Name:
2-(1-tert-butylcyclopropyl)-4,4-dimethyl-5H-1,3-oxazole
InChI:
InChI=1S/C12H21NO/c1-10(2,3)12(6-7-12)9-13-11(4,5)8-14-9/h6-8H2,1-5H3
InChI Key:
CNPFZRMUICNYPB-UHFFFAOYSA-N
SMILES:
CC1(C)COC(=N1)C1(CC1)C(C)(C)C
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.162g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.306g/mol
Monoisotopic Mass:
195.162g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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