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121758-10-9 | Cyclododecane, (phenylmethoxy)-
CAS No: 121758-10-9 Catalog No: AG0015TA MDL No:
Product Description
Catalog Number:
AG0015TA
Chemical Name:
Cyclododecane, (phenylmethoxy)-
CAS Number:
121758-10-9
Molecular Formula:
C19H30O
Molecular Weight:
274.4409
IUPAC Name:
phenylmethoxycyclododecane
InChI:
InChI=1S/C19H30O/c1-2-4-6-11-15-19(16-12-7-5-3-1)20-17-18-13-9-8-10-14-18/h8-10,13-14,19H,1-7,11-12,15-17H2
InChI Key:
YLDPUVRZKGGXDW-UHFFFAOYSA-N
SMILES:
C1CCCCCCCCCC(C1)OCc1ccccc1
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.23g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.448g/mol
Monoisotopic Mass:
274.23g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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