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85-24-5

85-24-5 | Methanone,[2-hydroxy-4-(octyloxy)phenyl](2-hydroxyphenyl)-

CAS No: 85-24-5 Catalog No: AG004V7T MDL No:MFCD00020039

Product Description

Catalog Number:
AG004V7T
Chemical Name:
Methanone,[2-hydroxy-4-(octyloxy)phenyl](2-hydroxyphenyl)-
CAS Number:
85-24-5
Molecular Formula:
C21H26O4
Molecular Weight:
342.4287
MDL Number:
MFCD00020039
IUPAC Name:
(2-hydroxy-4-octoxyphenyl)-(2-hydroxyphenyl)methanone
InChI:
InChI=1S/C21H26O4/c1-2-3-4-5-6-9-14-25-16-12-13-18(20(23)15-16)21(24)17-10-7-8-11-19(17)22/h7-8,10-13,15,22-23H,2-6,9,14H2,1H3
InChI Key:
XRCGPZWJUXJKJF-UHFFFAOYSA-N
SMILES:
CCCCCCCCOc1ccc(c(c1)O)C(=O)c1ccccc1O
EC Number:
201-594-6

Properties

Complexity:
384  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.183g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
342.435g/mol
Monoisotopic Mass:
342.183g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5  

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