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37972-89-7 | 2-iodothiophenol
CAS No: 37972-89-7 Catalog No: AG00CM84 MDL No:MFCD18451700
Product Description
Catalog Number:
AG00CM84
Chemical Name:
2-iodothiophenol
CAS Number:
37972-89-7
Molecular Formula:
C6H5IS
Molecular Weight:
236.0734
MDL Number:
MFCD18451700
IUPAC Name:
2-iodobenzenethiol
InChI:
InChI=1S/C6H5IS/c7-5-3-1-2-4-6(5)8/h1-4,8H
InChI Key:
QZOCQWGVJOPBDK-UHFFFAOYSA-N
SMILES:
Sc1ccccc1I
Properties
Complexity:
74.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.916g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.07g/mol
Monoisotopic Mass:
235.916g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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