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131748-91-9 | Thiazole, 2-bromo-5-(bromomethyl)-
CAS No: 131748-91-9 Catalog No: AG000ZOR MDL No:MFCD07368378
Product Description
Catalog Number:
AG000ZOR
Chemical Name:
Thiazole, 2-bromo-5-(bromomethyl)-
CAS Number:
131748-91-9
Molecular Formula:
C4H3Br2NS
Molecular Weight:
256.9463
MDL Number:
MFCD07368378
IUPAC Name:
2-bromo-5-(bromomethyl)-1,3-thiazole
InChI:
InChI=1S/C4H3Br2NS/c5-1-3-2-7-4(6)8-3/h2H,1H2
InChI Key:
YYHRYECWWYONCH-UHFFFAOYSA-N
SMILES:
BrCc1cnc(s1)Br
Properties
Complexity:
80.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.833g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.943g/mol
Monoisotopic Mass:
254.835g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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