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2878-57-1 | Benzene, 1-[[1-[(2-ethylhexyl)oxy]ethoxy]methyl]-2,3-dimethoxy-
CAS No: 2878-57-1 Catalog No: AG002WG6 MDL No:
Product Description
Catalog Number:
AG002WG6
Chemical Name:
Benzene, 1-[[1-[(2-ethylhexyl)oxy]ethoxy]methyl]-2,3-dimethoxy-
CAS Number:
2878-57-1
Molecular Formula:
C19H32O4
Molecular Weight:
324.4550
IUPAC Name:
1-[1-(2-ethylhexoxy)ethoxymethyl]-2,3-dimethoxybenzene
InChI:
InChI=1S/C19H32O4/c1-6-8-10-16(7-2)13-22-15(3)23-14-17-11-9-12-18(20-4)19(17)21-5/h9,11-12,15-16H,6-8,10,13-14H2,1-5H3
InChI Key:
ZZGKAHQQYQUQRC-UHFFFAOYSA-N
SMILES:
CCCCC(COC(OCc1cccc(c1OC)OC)C)CC
NSC Number:
14344
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.23g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
324.461g/mol
Monoisotopic Mass:
324.23g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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