Home Halogens 5-[(4-bromo-1H-pyrazol-1-yl)methyl]-2-chloro-1,3-thiazole

5-[(4-bromo-1H-pyrazol-1-yl)methyl]-2-chloro-1,3-thiazole

CAS No.:
1525598-55-3
Catalog Number:
AG01ACY9
Molecular Formula:
C7H5BrClN3S
Molecular Weight:
278.5567
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Product Description
Catalog Number:
AG01ACY9
Chemical Name:
5-[(4-bromo-1H-pyrazol-1-yl)methyl]-2-chloro-1,3-thiazole
CAS Number:
1525598-55-3
Molecular Formula:
C7H5BrClN3S
Molecular Weight:
278.5567
MDL Number:
MFCD23765893
IUPAC Name:
5-[(4-bromopyrazol-1-yl)methyl]-2-chloro-1,3-thiazole
InChI:
InChI=1S/C7H5BrClN3S/c8-5-1-11-12(3-5)4-6-2-10-7(9)13-6/h1-3H,4H2
InChI Key:
LPIDRJGAMAKMTA-UHFFFAOYSA-N
SMILES:
Brc1cnn(c1)Cc1cnc(s1)Cl
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.908g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.552g/mol
Monoisotopic Mass:
276.908g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties