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885279-46-9 | 2-(3-Bromobenzyl)thiazol-4-amine
CAS No: 885279-46-9 Catalog No: AG0045UQ MDL No:MFCD06738475
Product Description
Catalog Number:
AG0045UQ
Chemical Name:
2-(3-Bromobenzyl)thiazol-4-amine
CAS Number:
885279-46-9
Molecular Formula:
C10H9BrN2S
Molecular Weight:
269.1609
MDL Number:
MFCD06738475
IUPAC Name:
2-[(3-bromophenyl)methyl]-1,3-thiazol-4-amine
InChI:
InChI=1S/C10H9BrN2S/c11-8-3-1-2-7(4-8)5-10-13-9(12)6-14-10/h1-4,6H,5,12H2
InChI Key:
HOLWJJDTGIPINA-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)Cc1scc(n1)N
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.967g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.16g/mol
Monoisotopic Mass:
267.967g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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