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10242-01-0,MFCD03265451
Catalog No.:AA0007C3
10242-01-0 | 5-Methoxyindole-3-carboxylic acid
Pack Size
Purity
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Price(USD)
Quantity
  
250mg
98%
in stock  
$22.00   $15.00
- +
1g
98%
in stock  
$56.00   $39.00
- +
5g
95%
in stock  
$165.00   $115.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0007C3
Chemical Name:
5-Methoxyindole-3-carboxylic acid
CAS Number:
10242-01-0
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
MDL Number:
MFCD03265451
IUPAC Name:
5-methoxy-1H-indole-3-carboxylic acid
InChI:
InChI=1S/C10H9NO3/c1-14-6-2-3-9-7(4-6)8(5-11-9)10(12)13/h2-5,11H,1H3,(H,12,13)
InChI Key:
RVVSEZGJCOAUED-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c(c[nH]2)C(=O)O
NSC Number:
88877
Properties
Computed Properties
 
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.058g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
191.186g/mol
Monoisotopic Mass:
191.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
62.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

Synonyms
 
5-Methoxy-1H-indole-3-carboxylic acid 
10242-01-0 
AC1L60LV 
AC1Q4F1M 
AC1Q5UN0 
SCHEMBL592889 
CTK0I3423 
DTXSID40293353 
ZLE0051 
RVVSEZGJCOAUED-UHFFFAOYSA-N 
WT599 
ACT03563 
5-Methoxyindole-3-carboxylic acid 
KS-00000G7E 
ZINC1569527 
ANW-48883 
BBL010858 
CM-233 
NSC-88877 
SBB066630 
STK642188 
AKOS000302731 
AB13930 
5-methoxy-3-indolecarboxylic acid 
AC-6602 
AN-9841 
AS06059 
CM13616 
CS-W000793 
FS-2267 
LS20291 
MCULE-8485866109 
RP25083 
TRA0076374 
5-methoxy-3-carboxyindole 
1H-Indole-3-carboxylicacid, 5-methoxy- 
AJ-27172 
AK-30227 
BC203550 
BR-30227 
SC-00109 
AB0034456 
AB1005672 
DB-007077 
ST2412062 
1H-INDOLE-3-CARBOXYLIC ACID, 5-METHOXY- 
TR-000606 
4CH-007290 
FT-0080045 
FT-0630300 
M2438 
ST50342017 
X8613 
EN300-71417 
5-methoxyindole-3-carboxylic acid, AldrichCPR 
S-2551 
MFCD03265451 
10242-01-0 5-methoxy-3-indolecarboxylic acid 
242M010 
I10-0082 
Q-101968 
Z1171979216 
5-Methoxyindole-3-carboxylic acid; 5-Methoxy-1H-indole-3-carboxylic acid 
5-Methoxyindole-3-carboxylic acid[5-methoxy-1H-indazole-3-carboxylic acid] 
C10H9NO3 
AR-1G8660 
CID259191 
NSC88877 
5-Methoxy-1H-indole-3-carboxylicacid 
102433-70-5 
91419-52-2 
PubChem7984 
zlchem 1276 
Literature

Title: In vitro metabolism of tegaserod in human liver and intestine: assessment of drug interactions.

Journal: Drug metabolism and disposition: the biological fate of chemicals 20011001

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