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88953-17-7

88953-17-7 | Phenol, 4-[1-(4-hydroxyphenyl)-1-methylethyl]-2-iodo-

CAS No: 88953-17-7 Catalog No: AG0089R6 MDL No:

Product Description

Catalog Number:
AG0089R6
Chemical Name:
Phenol, 4-[1-(4-hydroxyphenyl)-1-methylethyl]-2-iodo-
CAS Number:
88953-17-7
Molecular Formula:
C15H15IO2
Molecular Weight:
354.1829
IUPAC Name:
4-[2-(4-hydroxyphenyl)propan-2-yl]-2-iodophenol
InChI:
InChI=1S/C15H15IO2/c1-15(2,10-3-6-12(17)7-4-10)11-5-8-14(18)13(16)9-11/h3-9,17-18H,1-2H3
InChI Key:
UTSRSZPCDQMREH-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)C(c1ccc(c(c1)I)O)(C)C

Properties

Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.012g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
354.187g/mol
Monoisotopic Mass:
354.012g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  

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