Home Aminos Ethyl 2-(2-aminothiazol-4-yl)butanoate

Ethyl 2-(2-aminothiazol-4-yl)butanoate

CAS No.:
412311-88-7
Catalog Number:
AG00I82J
Molecular Formula:
C9H14N2O2S
Molecular Weight:
214.2847
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Product Description
Catalog Number:
AG00I82J
Chemical Name:
Ethyl 2-(2-aminothiazol-4-yl)butanoate
CAS Number:
412311-88-7
Molecular Formula:
C9H14N2O2S
Molecular Weight:
214.2847
MDL Number:
MFCD23702111
IUPAC Name:
ethyl 2-(2-amino-1,3-thiazol-4-yl)butanoate
InChI:
InChI=1S/C9H14N2O2S/c1-3-6(8(12)13-4-2)7-5-14-9(10)11-7/h5-6H,3-4H2,1-2H3,(H2,10,11)
InChI Key:
ZKPUWDUVLLOOQK-UHFFFAOYSA-N
SMILES:
CCC(c1csc(=N)[nH]1)C(=O)OCC
Properties
Complexity:
201  
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:
5  
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties