Home Other Building Blocks 4-BROMO-THIOPHENE-3-CARBOTHIOIC ACID AMIDE

4-BROMO-THIOPHENE-3-CARBOTHIOIC ACID AMIDE

CAS No.:
1379334-23-2
Catalog Number:
AG01DYPX
Molecular Formula:
C5H4BrNS2
Molecular Weight:
222.1260
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Product Description
Catalog Number:
AG01DYPX
Chemical Name:
4-BROMO-THIOPHENE-3-CARBOTHIOIC ACID AMIDE
CAS Number:
1379334-23-2
Molecular Formula:
C5H4BrNS2
Molecular Weight:
222.1260
MDL Number:
MFCD19689190
IUPAC Name:
4-bromothiophene-3-carbothioamide
InChI:
InChI=1S/C5H4BrNS2/c6-4-2-9-1-3(4)5(7)8/h1-2H,(H2,7,8)
InChI Key:
ICXPIQFLOXBPOO-UHFFFAOYSA-N
SMILES:
NC(=S)c1cscc1Br
Properties
Complexity:
128  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.897g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.118g/mol
Monoisotopic Mass:
220.897g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties