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629-98-1 | CIS-13-DOCOSENOL
CAS No: 629-98-1 Catalog No: AG0034M7 MDL No:MFCD00055936
Product Description
Catalog Number:
AG0034M7
Chemical Name:
CIS-13-DOCOSENOL
CAS Number:
629-98-1
Molecular Formula:
C22H44O
Molecular Weight:
324.5842
MDL Number:
MFCD00055936
IUPAC Name:
(Z)-docos-13-en-1-ol
InChI:
InChI=1S/C22H44O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h9-10,23H,2-8,11-22H2,1H3/b10-9-
InChI Key:
CFOQKXQWGLAKSK-KTKRTIGZSA-N
SMILES:
CCCCCCCC/C=C\CCCCCCCCCCCCO
EC Number:
211-122-0
UNII:
1OOE093KBY
NSC Number:
2311
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
324.339g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
324.593g/mol
Monoisotopic Mass:
324.339g/mol
Rotatable Bond Count:
19
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.6
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