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85013-51-0

85013-51-0 | Benzene, 1-(ethoxyphenylmethoxy)-3-methoxy-

CAS No: 85013-51-0 Catalog No: AG0050P5 MDL No:

Product Description

Catalog Number:
AG0050P5
Chemical Name:
Benzene, 1-(ethoxyphenylmethoxy)-3-methoxy-
CAS Number:
85013-51-0
Molecular Formula:
C16H18O3
Molecular Weight:
258.3123
IUPAC Name:
1-[ethoxy(phenyl)methoxy]-3-methoxybenzene
InChI:
InChI=1S/C16H18O3/c1-3-18-16(13-8-5-4-6-9-13)19-15-11-7-10-14(12-15)17-2/h4-12,16H,3H2,1-2H3
InChI Key:
FZZVBCRHNIBKDD-UHFFFAOYSA-N
SMILES:
CCOC(c1ccccc1)Oc1cccc(c1)OC

Properties

Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.126g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.317g/mol
Monoisotopic Mass:
258.126g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

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