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2059933-04-7 | 5-(cyclohex-2-en-1-yl)-3-methyl-1,2-oxazole
CAS No: 2059933-04-7 Catalog No: AG01BOI0 MDL No:MFCD30499149
Product Description
Catalog Number:
AG01BOI0
Chemical Name:
5-(cyclohex-2-en-1-yl)-3-methyl-1,2-oxazole
CAS Number:
2059933-04-7
Molecular Formula:
C10H13NO
Molecular Weight:
163.2163
MDL Number:
MFCD30499149
IUPAC Name:
5-cyclohex-2-en-1-yl-3-methyl-1,2-oxazole
InChI:
InChI=1S/C10H13NO/c1-8-7-10(12-11-8)9-5-3-2-4-6-9/h3,5,7,9H,2,4,6H2,1H3
InChI Key:
MFRBWPZQLAHEJZ-UHFFFAOYSA-N
SMILES:
Cc1cc(on1)C1CCCC=C1
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.1g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.22g/mol
Monoisotopic Mass:
163.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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