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61929-24-6 | 2-Bromo-1,3,4-thiadiazole
CAS No: 61929-24-6 Catalog No: AG00334S MDL No:MFCD04115375
Product Description
Catalog Number:
AG00334S
Chemical Name:
2-Bromo-1,3,4-thiadiazole
CAS Number:
61929-24-6
Molecular Formula:
C2HBrN2S
Molecular Weight:
165.0117
MDL Number:
MFCD04115375
IUPAC Name:
2-bromo-1,3,4-thiadiazole
InChI:
InChI=1S/C2HBrN2S/c3-2-5-4-1-6-2/h1H
InChI Key:
DQBCRVIBTFHJLM-UHFFFAOYSA-N
SMILES:
Brc1nncs1
Properties
Complexity:
50.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.904g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.008g/mol
Monoisotopic Mass:
163.904g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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