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71520-00-8 | 2-HEXADECENOIC ACID ANHYDRIDE
CAS No: 71520-00-8 Catalog No: AG005H4F MDL No:
Product Description
Catalog Number:
AG005H4F
Chemical Name:
2-HEXADECENOIC ACID ANHYDRIDE
CAS Number:
71520-00-8
Molecular Formula:
C32H58O3
Molecular Weight:
490.8011
IUPAC Name:
hexadec-2-enoyl hexadec-2-enoate
InChI:
InChI=1S/C32H58O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31(33)35-32(34)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h27-30H,3-26H2,1-2H3
InChI Key:
CFJSABLFNNINIE-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCC=CC(=O)OC(=O)C=CCCCCCCCCCCCCC
Properties
Complexity:
475
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
490.439g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
490.813g/mol
Monoisotopic Mass:
490.439g/mol
Rotatable Bond Count:
28
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
14.3
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