Home Other Building Blocks 2-(3-cyclopropaneamidophenoxy)acetic acid

2-(3-cyclopropaneamidophenoxy)acetic acid

CAS No.:
890984-16-4
Catalog Number:
AG019M0K
Molecular Formula:
C12H13NO4
Molecular Weight:
235.2359
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Product Description
Catalog Number:
AG019M0K
Chemical Name:
2-(3-cyclopropaneamidophenoxy)acetic acid
CAS Number:
890984-16-4
Molecular Formula:
C12H13NO4
Molecular Weight:
235.2359
MDL Number:
MFCD07113971
IUPAC Name:
2-[3-(cyclopropanecarbonylamino)phenoxy]acetic acid
InChI:
InChI=1S/C12H13NO4/c14-11(15)7-17-10-3-1-2-9(6-10)13-12(16)8-4-5-8/h1-3,6,8H,4-5,7H2,(H,13,16)(H,14,15)
InChI Key:
FWXXKIDBHZJNTO-UHFFFAOYSA-N
SMILES:
OC(=O)COc1cccc(c1)NC(=O)C1CC1
Properties
Complexity:
301  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.084g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
235.239g/mol
Monoisotopic Mass:
235.084g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties