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114804-20-5 | 6-Tetradecenedioic acid, 10-ethenyl-
CAS No: 114804-20-5 Catalog No: AG000F97 MDL No:
Product Description
Catalog Number:
AG000F97
Chemical Name:
6-Tetradecenedioic acid, 10-ethenyl-
CAS Number:
114804-20-5
Molecular Formula:
C16H26O4
Molecular Weight:
282.3752
IUPAC Name:
10-ethenyltetradec-6-enedioic acid
InChI:
InChI=1S/C16H26O4/c1-2-14(11-9-13-16(19)20)10-7-5-3-4-6-8-12-15(17)18/h2-3,5,14H,1,4,6-13H2,(H,17,18)(H,19,20)
InChI Key:
MRWZUVHMODNNCM-UHFFFAOYSA-N
SMILES:
C=CC(CCC=CCCCCC(=O)O)CCCC(=O)O
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.183g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
282.38g/mol
Monoisotopic Mass:
282.183g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.7
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