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18812-40-3 | 3-Thiophenecarboxaldehyde, 2-iodo-
CAS No: 18812-40-3 Catalog No: AG002GQD MDL No:MFCD03426915
Product Description
Catalog Number:
AG002GQD
Chemical Name:
3-Thiophenecarboxaldehyde, 2-iodo-
CAS Number:
18812-40-3
Molecular Formula:
C5H3IOS
Molecular Weight:
238.0462
MDL Number:
MFCD03426915
IUPAC Name:
2-iodothiophene-3-carbaldehyde
InChI:
InChI=1S/C5H3IOS/c6-5-4(3-7)1-2-8-5/h1-3H
InChI Key:
XQBBCHBIMBAUEN-UHFFFAOYSA-N
SMILES:
Ic1sccc1C=O
Properties
Complexity:
96.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.895g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.042g/mol
Monoisotopic Mass:
237.895g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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