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138109-87-2

138109-87-2 | Phenol, 4,4'-(iodo-125I-phenylethenylidene)bis- (9CI)

CAS No: 138109-87-2 Catalog No: AG0017ZO MDL No:

Product Description

Catalog Number:
AG0017ZO
Chemical Name:
Phenol, 4,4'-(iodo-125I-phenylethenylidene)bis- (9CI)
CAS Number:
138109-87-2
Molecular Formula:
C20H15IO2
Molecular Weight:
414.2364
IUPAC Name:
4-[1-(4-hydroxyphenyl)-2-iodo-2-phenylethenyl]phenol
InChI:
InChI=1S/C20H15IO2/c21-20(16-4-2-1-3-5-16)19(14-6-10-17(22)11-7-14)15-8-12-18(23)13-9-15/h1-13,22-23H
InChI Key:
UZROBUMQMJPIIU-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)C(=C(c1ccccc1)I)c1ccc(cc1)O
UNII:
V2R5XJJMKY

Properties

Complexity:
374  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
414.012g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
414.242g/mol
Monoisotopic Mass:
414.012g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3  

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