Home Other Building Blocks 2-BROMO-5-(METHOXYMETHYL)-1,3,4-THIADIAZOLE

2-BROMO-5-(METHOXYMETHYL)-1,3,4-THIADIAZOLE

CAS No.:
61450-91-7
Catalog Number:
AG01DWJC
Molecular Formula:
C4H5BrN2OS
Molecular Weight:
209.0643
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Product Description
Catalog Number:
AG01DWJC
Chemical Name:
2-BROMO-5-(METHOXYMETHYL)-1,3,4-THIADIAZOLE
CAS Number:
61450-91-7
Molecular Formula:
C4H5BrN2OS
Molecular Weight:
209.0643
MDL Number:
MFCD08436692
IUPAC Name:
2-bromo-5-(methoxymethyl)-1,3,4-thiadiazole
InChI:
InChI=1S/C4H5BrN2OS/c1-8-2-3-6-7-4(5)9-3/h2H2,1H3
InChI Key:
WLFHBDROTUDXEH-UHFFFAOYSA-N
SMILES:
COCc1nnc(s1)Br
Properties
Complexity:
94.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.931g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.061g/mol
Monoisotopic Mass:
207.931g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties