Home Other Building Blocks 2-[4-(prop-2-ynamido)phenyl]acetic acid

2-[4-(prop-2-ynamido)phenyl]acetic acid

CAS No.:
1016865-10-3
Catalog Number:
AG01AUUI
Molecular Formula:
C11H9NO3
Molecular Weight:
203.1941
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Product Description
Catalog Number:
AG01AUUI
Chemical Name:
2-[4-(prop-2-ynamido)phenyl]acetic acid
CAS Number:
1016865-10-3
Molecular Formula:
C11H9NO3
Molecular Weight:
203.1941
MDL Number:
MFCD09945626
IUPAC Name:
2-[4-(prop-2-ynoylamino)phenyl]acetic acid
InChI:
InChI=1S/C11H9NO3/c1-2-10(13)12-9-5-3-8(4-6-9)7-11(14)15/h1,3-6H,7H2,(H,12,13)(H,14,15)
InChI Key:
UERZSBQTBIIUTQ-UHFFFAOYSA-N
SMILES:
C#CC(=O)Nc1ccc(cc1)CC(=O)O
Properties
Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.058g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
203.197g/mol
Monoisotopic Mass:
203.058g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties