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1071329-00-4

1071329-00-4 | 2-Diethylamino-4-methyl-thiazole-5-carboxylic acid

CAS No: 1071329-00-4 Catalog No: AG01F8XC MDL No:

Product Description

Catalog Number:
AG01F8XC
Chemical Name:
2-Diethylamino-4-methyl-thiazole-5-carboxylic acid
CAS Number:
1071329-00-4
Molecular Formula:
C9H14N2O2S
Molecular Weight:
214.2847
IUPAC Name:
2-(diethylamino)-4-methyl-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C9H14N2O2S/c1-4-11(5-2)9-10-6(3)7(14-9)8(12)13/h4-5H2,1-3H3,(H,12,13)
InChI Key:
CIPKPNGMPXQRBG-UHFFFAOYSA-N
SMILES:
CCN(c1nc(c(s1)C(=O)O)C)CC

Properties

Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.078g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
214.283g/mol
Monoisotopic Mass:
214.078g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
81.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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