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100314-68-9 | 1-Cyclodecen-1-ol, 1-acetate
CAS No: 100314-68-9 Catalog No: AG0001LO MDL No:
Product Description
Catalog Number:
AG0001LO
Chemical Name:
1-Cyclodecen-1-ol, 1-acetate
CAS Number:
100314-68-9
Molecular Formula:
C12H20O2
Molecular Weight:
196.2860
IUPAC Name:
acetic acid;cyclodecen-1-ol
InChI:
InChI=1S/C10H18O.C2H4O2/c11-10-8-6-4-2-1-3-5-7-9-10;1-2(3)4/h8,11H,1-7,9H2;1H3,(H,3,4)
InChI Key:
FTXXGVIWTIPJTC-UHFFFAOYSA-N
SMILES:
CC(=O)OC1=CCCCCCCCC1
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.157g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
214.305g/mol
Monoisotopic Mass:
214.157g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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