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925-84-8 | 7-Tetradecenedioic acid, dimethyl ester
CAS No: 925-84-8 Catalog No: AG006GMR MDL No:
Product Description
Catalog Number:
AG006GMR
Chemical Name:
7-Tetradecenedioic acid, dimethyl ester
CAS Number:
925-84-8
Molecular Formula:
C16H28O4
Molecular Weight:
284.3911
IUPAC Name:
dimethyl tetradec-7-enedioate
InChI:
InChI=1S/C16H28O4/c1-19-15(17)13-11-9-7-5-3-4-6-8-10-12-14-16(18)20-2/h3-4H,5-14H2,1-2H3
InChI Key:
PNLUBTYXDPSADQ-UHFFFAOYSA-N
SMILES:
COC(=O)CCCCCC=CCCCCCC(=O)OC
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.199g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.396g/mol
Monoisotopic Mass:
284.199g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.2
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