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144356-45-6 | 7-Hexadecenedioic acid, 10-ethenyl-
CAS No: 144356-45-6 Catalog No: AG001JEL MDL No:
Product Description
Catalog Number:
AG001JEL
Chemical Name:
7-Hexadecenedioic acid, 10-ethenyl-
CAS Number:
144356-45-6
Molecular Formula:
C18H30O4
Molecular Weight:
310.4284
IUPAC Name:
10-ethenylhexadec-7-enedioic acid
InChI:
InChI=1S/C18H30O4/c1-2-16(13-9-7-11-15-18(21)22)12-8-5-3-4-6-10-14-17(19)20/h2,5,8,16H,1,3-4,6-7,9-15H2,(H,19,20)(H,21,22)
InChI Key:
UVWLTNRLOKTAJW-UHFFFAOYSA-N
SMILES:
C=CC(CC=CCCCCCC(=O)O)CCCCCC(=O)O
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.214g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
310.434g/mol
Monoisotopic Mass:
310.214g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
4.8
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