Home Other Building Blocks 2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetic acid

2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetic acid

CAS No.:
1050885-30-7
Catalog Number:
AG019MDH
Molecular Formula:
C10H9NO3S
Molecular Weight:
223.2484
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Product Description
Catalog Number:
AG019MDH
Chemical Name:
2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetic acid
CAS Number:
1050885-30-7
Molecular Formula:
C10H9NO3S
Molecular Weight:
223.2484
MDL Number:
MFCD10686779
IUPAC Name:
2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetic acid
InChI:
InChI=1S/C10H9NO3S/c1-6-2-3-8(14-6)10-11-7(5-15-10)4-9(12)13/h2-3,5H,4H2,1H3,(H,12,13)
InChI Key:
YDVDHYNCXQZRMG-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1csc(n1)c1ccc(o1)C
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.03g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
223.246g/mol
Monoisotopic Mass:
223.03g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties