Home Other Building Blocks 2-[2-(thiophen-2-yl)-1,3-oxazol-4-yl]acetic acid

2-[2-(thiophen-2-yl)-1,3-oxazol-4-yl]acetic acid

CAS No.:
1082414-36-5
Catalog Number:
AG01AB4Y
Molecular Formula:
C9H7NO3S
Molecular Weight:
209.2218
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Product Description
Catalog Number:
AG01AB4Y
Chemical Name:
2-[2-(thiophen-2-yl)-1,3-oxazol-4-yl]acetic acid
CAS Number:
1082414-36-5
Molecular Formula:
C9H7NO3S
Molecular Weight:
209.2218
MDL Number:
MFCD11587880
IUPAC Name:
2-(2-thiophen-2-yl-1,3-oxazol-4-yl)acetic acid
InChI:
InChI=1S/C9H7NO3S/c11-8(12)4-6-5-13-9(10-6)7-2-1-3-14-7/h1-3,5H,4H2,(H,11,12)
InChI Key:
KYLXRJJKQSNTHJ-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1coc(n1)c1cccs1
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.015g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
209.219g/mol
Monoisotopic Mass:
209.015g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties