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122182-51-8 | 10,12,14-Hexadecatrien-1-ol, acetate, (10Z,12E,14E)- (9CI)
CAS No: 122182-51-8 Catalog No: AG0016WV MDL No:
Product Description
Catalog Number:
AG0016WV
Chemical Name:
10,12,14-Hexadecatrien-1-ol, acetate, (10Z,12E,14E)- (9CI)
CAS Number:
122182-51-8
Molecular Formula:
C18H30O2
Molecular Weight:
278.4296
IUPAC Name:
acetic acid;hexadeca-10,12,14-trien-1-ol
InChI:
InChI=1S/C16H28O.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17;1-2(3)4/h2-7,17H,8-16H2,1H3;1H3,(H,3,4)
InChI Key:
LOAMWUPKVZTMFM-UHFFFAOYSA-N
SMILES:
C/C=C/C=C/C=C\CCCCCCCCCOC(=O)C
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.235g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
296.451g/mol
Monoisotopic Mass:
296.235g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
3
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