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4919-34-0,MFCD00016557
Catalog No.:AA003I1H
4919-34-0 | 3-(4-Ethoxyphenyl)propanoic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$28.00   $19.00
- +
5g
95%
in stock  
$78.00   $54.00
- +
10g
95%
in stock  
$122.00   $85.00
- +
25g
95%
in stock  
$269.00   $188.00
  • Technical Information
  • Properties
  • Literature
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003I1H
Chemical Name:
3-(4-Ethoxyphenyl)propanoic acid
CAS Number:
4919-34-0
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
MDL Number:
MFCD00016557
IUPAC Name:
3-(4-ethoxyphenyl)propanoic acid
InChI:
InChI=1S/C11H14O3/c1-2-14-10-6-3-9(4-7-10)5-8-11(12)13/h3-4,6-7H,2,5,8H2,1H3,(H,12,13)
InChI Key:
ZDSHOEQSCJOGCK-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)CCC(=O)O
NSC Number:
157580
Properties
Computed Properties
 
Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.094g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
194.23g/mol
Monoisotopic Mass:
194.094g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

Synonyms
 
3-(4-ethoxyphenyl)propanoic acid 
4919-34-0 
AC1Q37I6 
SCHEMBL1205605 
CTK3J5469 
DTXSID20303262 
ZDSHOEQSCJOGCK-UHFFFAOYSA-N 
HMS1522N05 
ZINC129386 
3-(4-Ethoxyphenyl)-propionic acid 
ALBB-029467 
3-(4-Ethoxy-phenyl)-propionic acid 
3-(4-ETHOXYPHENYL)PROPIONIC ACID 
4235AE 
SBB043645 
AKOS000196535 
MCULE-9998839199 
NSC-157580 
RTC-066405 
IDI1_031225 
NCGC00177355-01 
AJ-12083 
BAS 13482297 
benzenepropanoic acid, 4-ethoxy- 
DB-021654 
TC-066405 
FT-0658905 
ST50208619 
EN300-52321 
C-4894 
A827672 
I14-5128 
BRD-K37908965-001-01-7 
Z763367816 
MFCD00016557 
3- propionicacid 
3-(4-Ethoxyphenyl)propanoicacid 
C11H14O3 
AR-1H8708 
CID291985 
ACN-031417 
49828-75-3 
NSC157580 
ACMC-20ank3 
AC1Q5VWA 
Maybridge4_000643 
AC1L6H11 
Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: 3-(4-Ethoxy-benzo-yl)propionic acid.

Journal: Acta crystallographica. Section E, Structure reports online 20081101

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