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39785-81-4 | 3-Acetyl-2-(2,6-dimethyl-5-heptenyl)oxazolidine
CAS No: 39785-81-4 Catalog No: AG00CNWR MDL No:
Product Description
Catalog Number:
AG00CNWR
Chemical Name:
3-Acetyl-2-(2,6-dimethyl-5-heptenyl)oxazolidine
CAS Number:
39785-81-4
Molecular Formula:
C14H25NO2
Molecular Weight:
239.3538
IUPAC Name:
1-[2-(2,6-dimethylhept-5-enyl)-1,3-oxazolidin-3-yl]ethanone
InChI:
InChI=1S/C14H25NO2/c1-11(2)6-5-7-12(3)10-14-15(13(4)16)8-9-17-14/h6,12,14H,5,7-10H2,1-4H3
InChI Key:
RKYXURFVIOUABL-UHFFFAOYSA-N
SMILES:
CC(CC1OCCN1C(=O)C)CCC=C(C)C
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.189g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.359g/mol
Monoisotopic Mass:
239.189g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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