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1152475-40-5 | Thieno[3,2-d]pyrimidine, 2-chloro-7-iodo-
CAS No: 1152475-40-5 Catalog No: AG000GI7 MDL No:MFCD12406129
Product Description
Catalog Number:
AG000GI7
Chemical Name:
Thieno[3,2-d]pyrimidine, 2-chloro-7-iodo-
CAS Number:
1152475-40-5
Molecular Formula:
C6H2ClIN2S
Molecular Weight:
296.5159
MDL Number:
MFCD12406129
IUPAC Name:
2-chloro-7-iodothieno[3,2-d]pyrimidine
InChI:
InChI=1S/C6H2ClIN2S/c7-6-9-1-4-5(10-6)3(8)2-11-4/h1-2H
InChI Key:
KOQRTQSXTRRFIK-UHFFFAOYSA-N
SMILES:
Clc1ncc2c(n1)c(I)cs2
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:
2.9
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