Home Other Building Blocks 6-TERT-BUTYL-4-CHLOROTHIENO[2,3-D]PYRIMIDINE

6-TERT-BUTYL-4-CHLOROTHIENO[2,3-D]PYRIMIDINE

CAS No.:
439692-55-4
Catalog Number:
AG00D9YT
Molecular Formula:
C10H11ClN2S
Molecular Weight:
226.7257
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Product Description
Catalog Number:
AG00D9YT
Chemical Name:
6-TERT-BUTYL-4-CHLOROTHIENO[2,3-D]PYRIMIDINE
CAS Number:
439692-55-4
Molecular Formula:
C10H11ClN2S
Molecular Weight:
226.7257
MDL Number:
MFCD04973932
IUPAC Name:
6-tert-butyl-4-chlorothieno[2,3-d]pyrimidine
InChI:
InChI=1S/C10H11ClN2S/c1-10(2,3)7-4-6-8(11)12-5-13-9(6)14-7/h4-5H,1-3H3
InChI Key:
FNNJFDXFLFLEAD-UHFFFAOYSA-N
SMILES:
Clc1ncnc2c1cc(s2)C(C)(C)C
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.033g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.722g/mol
Monoisotopic Mass:
226.033g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Properties