Home Halogens 2-(bromomethyl)-4-phenylthiazole

2-(bromomethyl)-4-phenylthiazole

CAS No.:
78502-79-1
Catalog Number:
AG00537R
Molecular Formula:
C10H8BrNS
Molecular Weight:
254.1462
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Product Description
Catalog Number:
AG00537R
Chemical Name:
2-(bromomethyl)-4-phenylthiazole
CAS Number:
78502-79-1
Molecular Formula:
C10H8BrNS
Molecular Weight:
254.1462
MDL Number:
MFCD12405586
IUPAC Name:
2-(bromomethyl)-4-phenyl-1,3-thiazole
InChI:
InChI=1S/C10H8BrNS/c11-6-10-12-9(7-13-10)8-4-2-1-3-5-8/h1-5,7H,6H2
InChI Key:
MYRGZTAFPPWJGI-UHFFFAOYSA-N
SMILES:
BrCc1scc(n1)c1ccccc1
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.956g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.145g/mol
Monoisotopic Mass:
252.956g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties