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139035-14-6 | 26-Hentriaconten-1-ol, (Z)- (9CI)
CAS No: 139035-14-6 Catalog No: AG001A2D MDL No:
Product Description
Catalog Number:
AG001A2D
Chemical Name:
26-Hentriaconten-1-ol, (Z)- (9CI)
CAS Number:
139035-14-6
Molecular Formula:
C31H62O
Molecular Weight:
450.8234
IUPAC Name:
hentriacont-26-en-1-ol
InChI:
InChI=1S/C31H62O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32/h5-6,32H,2-4,7-31H2,1H3
InChI Key:
IFMQQJCFSDGLKC-UHFFFAOYSA-N
SMILES:
OCCCCCCCCCCCCCCCCCCCCCCCCC/C=C\CCCC
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
450.48g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
450.836g/mol
Monoisotopic Mass:
450.48g/mol
Rotatable Bond Count:
28
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
14.5
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