Home Halogens 2-(4-chloro-2-cyclohexylphenoxy)acetic acid

2-(4-chloro-2-cyclohexylphenoxy)acetic acid

CAS No.:
19774-97-1
Catalog Number:
AG019UZA
Molecular Formula:
C14H17ClO3
Molecular Weight:
268.7360
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Product Description
Catalog Number:
AG019UZA
Chemical Name:
2-(4-chloro-2-cyclohexylphenoxy)acetic acid
CAS Number:
19774-97-1
Molecular Formula:
C14H17ClO3
Molecular Weight:
268.7360
MDL Number:
MFCD09048751
IUPAC Name:
2-(4-chloro-2-cyclohexylphenoxy)acetic acid
InChI:
InChI=1S/C14H17ClO3/c15-11-6-7-13(18-9-14(16)17)12(8-11)10-4-2-1-3-5-10/h6-8,10H,1-5,9H2,(H,16,17)
InChI Key:
OGVODSDQXYUSDP-UHFFFAOYSA-N
SMILES:
OC(=O)COc1ccc(cc1C1CCCCC1)Cl
NSC Number:
26127
Properties
Complexity:
276  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.087g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
268.737g/mol
Monoisotopic Mass:
268.087g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Literature
Title Journal
2-Cycloalkyl phenoxyacetic acid CRTh2 receptor antagonists. Bioorganic & medicinal chemistry letters 20070801
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties