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Home > Other Building Blocks > 160496-16-2
160496-16-2 | Oxacyclotetradecan-2-one, 13-methyl-, (13R)-
CAS No: 160496-16-2 Catalog No: AG001RYJ MDL No:
Product Description
Catalog Number:
AG001RYJ
Chemical Name:
Oxacyclotetradecan-2-one, 13-methyl-, (13R)-
CAS Number:
160496-16-2
Molecular Formula:
C14H26O2
Molecular Weight:
226.3550
IUPAC Name:
(13R)-13-methyl-oxacyclotetradecan-2-one
InChI:
InChI=1S/C14H26O2/c1-13-10-8-6-4-2-3-5-7-9-11-14(15)16-12-13/h13H,2-12H2,1H3/t13-/m1/s1
InChI Key:
NFNWPPOMMYDNFQ-CYBMUJFWSA-N
SMILES:
C[C@@H]1CCCCCCCCCCC(=O)OC1
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
226.193g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.36g/mol
Monoisotopic Mass:
226.193g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
Literature
| Title | Journal |
|---|---|
| 'Brain aided' musk design. | Chemistry & biodiversity 20041201 |
| Constructing conformationally constrained macrobicyclic musks. | Chemistry (Weinheim an der Bergstrasse, Germany) 20010803 |
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