Home Halogens 1-[4-(3-chloro-4-fluorophenyl)-1,3-thiazol-2-yl]ethan-1-amine

1-[4-(3-chloro-4-fluorophenyl)-1,3-thiazol-2-yl]ethan-1-amine

CAS No.:
1248704-84-8
Catalog Number:
AG01A0H7
Molecular Formula:
C11H10ClFN2S
Molecular Weight:
256.7269
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Product Description
Catalog Number:
AG01A0H7
Chemical Name:
1-[4-(3-chloro-4-fluorophenyl)-1,3-thiazol-2-yl]ethan-1-amine
CAS Number:
1248704-84-8
Molecular Formula:
C11H10ClFN2S
Molecular Weight:
256.7269
MDL Number:
MFCD14628790
IUPAC Name:
1-[4-(3-chloro-4-fluorophenyl)-1,3-thiazol-2-yl]ethanamine
InChI:
InChI=1S/C11H10ClFN2S/c1-6(14)11-15-10(5-16-11)7-2-3-9(13)8(12)4-7/h2-6H,14H2,1H3
InChI Key:
IPXBGNZEHFYRHY-UHFFFAOYSA-N
SMILES:
CC(c1scc(n1)c1ccc(c(c1)Cl)F)N
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.024g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
256.723g/mol
Monoisotopic Mass:
256.024g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties