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885229-27-6 | 4-Chloro-5-iodothieno[2,3-d]pyrimidine
CAS No: 885229-27-6 Catalog No: AG0048FS MDL No:MFCD23135810
Product Description
Catalog Number:
AG0048FS
Chemical Name:
4-Chloro-5-iodothieno[2,3-d]pyrimidine
CAS Number:
885229-27-6
Molecular Formula:
C6H2ClIN2S
Molecular Weight:
296.5159
MDL Number:
MFCD23135810
IUPAC Name:
4-chloro-5-iodothieno[2,3-d]pyrimidine
InChI:
InChI=1S/C6H2ClIN2S/c7-5-4-3(8)1-11-6(4)10-2-9-5/h1-2H
InChI Key:
KMQCGVZKCHEYNQ-UHFFFAOYSA-N
SMILES:
Ic1csc2c1c(Cl)ncn2
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.867g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.51g/mol
Monoisotopic Mass:
295.867g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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