Home Other Building Blocks 1,2,3-Thiadiazole, 4-(4-methoxyphenyl)-

1,2,3-Thiadiazole, 4-(4-methoxyphenyl)-

CAS No.:
18212-22-1
Catalog Number:
AG0023ES
Molecular Formula:
C9H8N2OS
Molecular Weight:
192.2376
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Product Description
Catalog Number:
AG0023ES
Chemical Name:
1,2,3-Thiadiazole, 4-(4-methoxyphenyl)-
CAS Number:
18212-22-1
Molecular Formula:
C9H8N2OS
Molecular Weight:
192.2376
MDL Number:
MFCD24626394
IUPAC Name:
4-(4-methoxyphenyl)thiadiazole
InChI:
InChI=1S/C9H8N2OS/c1-12-8-4-2-7(3-5-8)9-6-13-11-10-9/h2-6H,1H3
InChI Key:
LQNFBURSZLZVSI-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1csnn1
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.036g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.236g/mol
Monoisotopic Mass:
192.036g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties