Home Carboxys potassium 2-(benzylamino)-1,3-thiazole-4-carboxylate

potassium 2-(benzylamino)-1,3-thiazole-4-carboxylate

CAS No.:
1015533-61-5
Catalog Number:
AG00H9HV
Molecular Formula:
C11H9KN2O2S
Molecular Weight:
272.3647
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Product Description
Catalog Number:
AG00H9HV
Chemical Name:
potassium 2-(benzylamino)-1,3-thiazole-4-carboxylate
CAS Number:
1015533-61-5
Molecular Formula:
C11H9KN2O2S
Molecular Weight:
272.3647
MDL Number:
MFCD06688766
IUPAC Name:
potassium;2-(benzylamino)-1,3-thiazole-4-carboxylate
InChI:
InChI=1S/C11H10N2O2S.K/c14-10(15)9-7-16-11(13-9)12-6-8-4-2-1-3-5-8;/h1-5,7H,6H2,(H,12,13)(H,14,15);/q;+1/p-1
InChI Key:
FQYOOOPONHBQDL-UHFFFAOYSA-M
SMILES:
[O-]C(=O)c1csc(n1)NCc1ccccc1.[K+]
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.002g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
272.363g/mol
Monoisotopic Mass:
272.002g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
93.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties