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121980-50-5 | Phenol, 2-iodo-3-methoxy-
CAS No: 121980-50-5 Catalog No: AG0016I2 MDL No:MFCD15527538
Product Description
Catalog Number:
AG0016I2
Chemical Name:
Phenol, 2-iodo-3-methoxy-
CAS Number:
121980-50-5
Molecular Formula:
C7H7IO2
Molecular Weight:
250.0337
MDL Number:
MFCD15527538
IUPAC Name:
2-iodo-3-methoxyphenol
InChI:
InChI=1S/C7H7IO2/c1-10-6-4-2-3-5(9)7(6)8/h2-4,9H,1H3
InChI Key:
DLVPKRMLAXQBGK-UHFFFAOYSA-N
SMILES:
COc1cccc(c1I)O
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.949g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.035g/mol
Monoisotopic Mass:
249.949g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| A strategy for the stereoselective synthesis of unsymmetric atropisomeric ligands: preparation of NAPhePHOS, a new biaryl diphosphine. | Chemistry (Weinheim an der Bergstrasse, Germany) 20020802 |
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