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6280-80-4,MFCD00003315
Catalog No.:AA003H9L
6280-80-4 | 2-(2-Formylphenoxy)acetic acid
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  • Technical Information
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  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003H9L
Chemical Name:
2-(2-Formylphenoxy)acetic acid
CAS Number:
6280-80-4
Molecular Formula:
C9H8O4
Molecular Weight:
180.1574
MDL Number:
MFCD00003315
IUPAC Name:
2-(2-formylphenoxy)acetic acid
InChI:
InChI=1S/C9H8O4/c10-5-7-3-1-2-4-8(7)13-6-9(11)12/h1-5H,6H2,(H,11,12)
InChI Key:
ANWMNLAAFDCKMT-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1OCC(=O)O
EC Number:
228-480-9
Properties
Computed Properties
 
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.042g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
180.159g/mol
Monoisotopic Mass:
180.042g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

Synonyms
 
2-Formylphenoxyacetic acid 
2-(2-Formylphenoxy)acetic acid 
Acetic acid, 2-(2-formylphenoxy)- 
CHEMBL384289 
ANWMNLAAFDCKMT-UHFFFAOYSA-N 
MFCD00003315 
NSC 6140 
EINECS 228-480-9 
NSC 133590 
o-Formyphenoxyacetic acid 
o-formyl phenoxyacetic acid 
2-formyl phenoxyacetic acid 
6280-80-4 
AC1L2G6R 
2-monoformylphenoxyacetic acid 
Integrase inhibitor, R2{3} 
(o-Formyl-phenoxy)acetic acid 
SCHEMBL354835 
acide formyl-2 phenoxyacetique 
Aceticacid,(2-formylphenoxy)- 
AC1Q764B 
DTXSID3064196 
CTK5B6136 
(2-Formylphenoxy)acetic acid 
KS-00001DQE 
NSC6140 
2-Formylphenoxyacetic acid, 97% 
SP655 
ZINC562681 
Acetic acid,2-(2-formylphenoxy)- 
CS-M3473 
NSC-6140 
BBL009148 
BDBM50200248 
o-Formylphenoxyacetic acid 
NSC133590 
SBB008189 
STK346861 
AKOS000113319 
FR-1038 
MCULE-7880702668 
NSC-133590 
DB-054295 
TR-021603 
FT-0608808 
Acetic acid, (2-formylphenoxy)- 
H2854 
ST45137541 
Z1608 
AE-848/00904006 
I04-9096 
5-Chlorovaleronitrile 
D0J2PW 
C9H8O4 
C9-H8-O4 
CID46533 
2-Carboxymethoxybenzaldehyde 
ortho-Formylphenoxyacetic acid 
Acetic acid, (o-formylphenoxy)- 
2-Formylphenoxyaceticacid 
Literature

Title: Design, synthesis and DNA binding activities of late first row transition metal(II) complexes of bi- functional tri - and tetratopic imines.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20121101

Title: N,N-Bis[2-(ethoxy-carbonyl-meth-oxy)-benzyl-idene]pyridine-2,6-dicarbohydrazide.

Journal: Acta crystallographica. Section E, Structure reports online 20080101

Title: Synthesis, characterization and antibacterial activity of azomethine derivatives derived from 2-formylphenoxyacetic acid.

Journal: Molecules (Basel, Switzerland) 20070222

Title: Novel selective orally active CRTH2 antagonists for allergic inflammation developed from in silico derived hits.

Journal: Journal of medicinal chemistry 20061116

Title: Synthesis and spectroscopic studies of new Schiff bases.

Journal: Molecules (Basel, Switzerland) 20060317

Title: Synthesis and preliminary characterization of a novel antiarrhythmic compound (KB130015) with an improved toxicity profile compared with amiodarone.

Journal: Journal of medicinal chemistry 20020131

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