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2059966-06-0 | 5-(cyclohex-2-en-1-yl)-3-(propan-2-yl)-1,2-oxazole
CAS No: 2059966-06-0 Catalog No: AG01BOIH MDL No:MFCD30499166
Product Description
Catalog Number:
AG01BOIH
Chemical Name:
5-(cyclohex-2-en-1-yl)-3-(propan-2-yl)-1,2-oxazole
CAS Number:
2059966-06-0
Molecular Formula:
C12H17NO
Molecular Weight:
191.2695
MDL Number:
MFCD30499166
IUPAC Name:
5-cyclohex-2-en-1-yl-3-propan-2-yl-1,2-oxazole
InChI:
InChI=1S/C12H17NO/c1-9(2)11-8-12(14-13-11)10-6-4-3-5-7-10/h4,6,8-10H,3,5,7H2,1-2H3
InChI Key:
HOIVFYVNWBUGSZ-UHFFFAOYSA-N
SMILES:
CC(c1noc(c1)C1CCCC=C1)C
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.131g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.274g/mol
Monoisotopic Mass:
191.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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