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927887-21-6

927887-21-6 | Phenol, 5-iodo-4-methoxy-2-(1-methylethyl)-

CAS No: 927887-21-6 Catalog No: AG00IHBY MDL No:MFCD16658587

Product Description

Catalog Number:
AG00IHBY
Chemical Name:
Phenol, 5-iodo-4-methoxy-2-(1-methylethyl)-
CAS Number:
927887-21-6
Molecular Formula:
C10H13IO2
Molecular Weight:
292.1135
MDL Number:
MFCD16658587
IUPAC Name:
5-iodo-4-methoxy-2-propan-2-ylphenol
InChI:
InChI=1S/C10H13IO2/c1-6(2)7-4-10(13-3)8(11)5-9(7)12/h4-6,12H,1-3H3
InChI Key:
DVGIWOUXRFMAFH-UHFFFAOYSA-N
SMILES:
COc1cc(C(C)C)c(cc1I)O

Properties

Complexity:
161  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.996g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
292.116g/mol
Monoisotopic Mass:
291.996g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

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