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18268-70-7 | Hexanoic acid, 2-ethyl-, 1,1'-[oxybis(2,1-ethanediyloxy-2,1-ethanediyl)] ester
CAS No: 18268-70-7 Catalog No: AG00241X MDL No:
Product Description
Catalog Number:
AG00241X
Chemical Name:
Hexanoic acid, 2-ethyl-, 1,1'-[oxybis(2,1-ethanediyloxy-2,1-ethanediyl)] ester
CAS Number:
18268-70-7
Molecular Formula:
C24H46O7
Molecular Weight:
446.6178
IUPAC Name:
2-[2-[2-[2-(2-ethylhexanoyloxy)ethoxy]ethoxy]ethoxy]ethyl 2-ethylhexanoate
InChI:
InChI=1S/C24H46O7/c1-5-9-11-21(7-3)23(25)30-19-17-28-15-13-27-14-16-29-18-20-31-24(26)22(8-4)12-10-6-2/h21-22H,5-20H2,1-4H3
InChI Key:
GYHPTPQZVBYHLC-UHFFFAOYSA-N
SMILES:
CCCCC(C(=O)OCCOCCOCCOCCOC(=O)C(CCCC)CC)CC
EC Number:
242-149-6
Properties
Complexity:
390
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
446.324g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
446.625g/mol
Monoisotopic Mass:
446.324g/mol
Rotatable Bond Count:
24
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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