Home Halogens 2-(2-bromophenyl)-1,3-thiazole-5-carboxylic acid

2-(2-bromophenyl)-1,3-thiazole-5-carboxylic acid

CAS No.:
1094385-77-9
Catalog Number:
AG01BXXC
Molecular Formula:
C10H6BrNO2S
Molecular Weight:
284.1291
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Product Description
Catalog Number:
AG01BXXC
Chemical Name:
2-(2-bromophenyl)-1,3-thiazole-5-carboxylic acid
CAS Number:
1094385-77-9
Molecular Formula:
C10H6BrNO2S
Molecular Weight:
284.1291
MDL Number:
MFCD11208451
IUPAC Name:
2-(2-bromophenyl)-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C10H6BrNO2S/c11-7-4-2-1-3-6(7)9-12-5-8(15-9)10(13)14/h1-5H,(H,13,14)
InChI Key:
ZLULNPWCVUGERD-UHFFFAOYSA-N
SMILES:
Brc1ccccc1c1ncc(s1)C(=O)O
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.93g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
284.127g/mol
Monoisotopic Mass:
282.93g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties