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37987-21-6 | 4-(HYDROXYMETHYL)-2-IODO-6-METHOXYPHENOL
CAS No: 37987-21-6 Catalog No: AG00CHP0 MDL No:MFCD00238615
Product Description
Catalog Number:
AG00CHP0
Chemical Name:
4-(HYDROXYMETHYL)-2-IODO-6-METHOXYPHENOL
CAS Number:
37987-21-6
Molecular Formula:
C8H9IO3
Molecular Weight:
280.0597
MDL Number:
MFCD00238615
IUPAC Name:
4-(hydroxymethyl)-2-iodo-6-methoxyphenol
InChI:
InChI=1S/C8H9IO3/c1-12-7-3-5(4-10)2-6(9)8(7)11/h2-3,10-11H,4H2,1H3
InChI Key:
YQQRUTNMNAZIAR-UHFFFAOYSA-N
SMILES:
COc1cc(CO)cc(c1O)I
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.96g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
280.061g/mol
Monoisotopic Mass:
279.96g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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