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60577-30-2 | 4-Iodo-2-methylphenol
CAS No: 60577-30-2 Catalog No: AG00342S MDL No:MFCD00075092
Product Description
Catalog Number:
AG00342S
Chemical Name:
4-Iodo-2-methylphenol
CAS Number:
60577-30-2
Molecular Formula:
C7H7IO
Molecular Weight:
234.0343
MDL Number:
MFCD00075092
IUPAC Name:
4-iodo-2-methylphenol
InChI:
InChI=1S/C7H7IO/c1-5-4-6(8)2-3-7(5)9/h2-4,9H,1H3
InChI Key:
WSBDSSKIWDFOBQ-UHFFFAOYSA-N
SMILES:
Ic1ccc(c(c1)C)O
Properties
Complexity:
94.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.954g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.036g/mol
Monoisotopic Mass:
233.954g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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