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35928-80-4 | Phenol, 2-iodo-5-methyl-
CAS No: 35928-80-4 Catalog No: AG00I74D MDL No:MFCD16997515
Product Description
Catalog Number:
AG00I74D
Chemical Name:
Phenol, 2-iodo-5-methyl-
CAS Number:
35928-80-4
Molecular Formula:
C7H7IO
Molecular Weight:
234.0344
MDL Number:
MFCD16997515
IUPAC Name:
2-iodo-5-methylphenol
InChI:
InChI=1S/C7H7IO/c1-5-2-3-6(8)7(9)4-5/h2-4,9H,1H3
InChI Key:
SYJGEJGXAKCKSI-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)O)I
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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