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10242-02-1,MFCD06203285
Catalog No.:AA0007CT
10242-02-1 | 5-Methyl-1H-indole-3-carboxylic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$18.00   $12.00
- +
1g
95%
in stock  
$32.00   $23.00
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5g
95%
in stock  
$132.00   $92.00
- +
  • Technical Information
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  • Q & A
  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA0007CT
Chemical Name:
5-Methyl-1H-indole-3-carboxylic acid
CAS Number:
10242-02-1
Molecular Formula:
C10H9NO2
Molecular Weight:
175.1840
MDL Number:
MFCD06203285
IUPAC Name:
5-methyl-1H-indole-3-carboxylic acid
InChI:
InChI=1S/C10H9NO2/c1-6-2-3-9-7(4-6)8(5-11-9)10(12)13/h2-5,11H,1H3,(H,12,13)
InChI Key:
TZNAHYKFVSHGDA-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)c(c[nH]2)C(=O)O
Properties
Computed Properties
 
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.063g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
175.187g/mol
Monoisotopic Mass:
175.063g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

Synonyms
 
5-Methyl-1H-indole-3-carboxylic acid 
10242-02-1 
KS-00000JYF 
DTXSID90593330 
TZNAHYKFVSHGDA-UHFFFAOYSA-N 
ACT07032 
ANW-14701 
MFCD06203285 
ZINC20269196 
AKOS005259106 
1H-Indole-3-carboxylicacid,5-methyl- 
CM-1937 
5-METHYLINDOLE-3-CARBOXYLIC ACID 
CS-W022409 
FS-3493 
QC-9741 
RP23716 
1H-Indole-3-carboxylicacid, 5-methyl- 
AJ-76731 
AK-32686 
AN-16420 
SC-12810 
SY046824 
PubChem15892 
AB0034457 
DB-003536 
ST2418818 
TC-020218 
4CH-012716 
FT-0687186 
X8614 
MFCD06203285 (95%) 
B-6276 
A800572 
1H-Indole-3-carboxylic acid, 5-methyl- 
J-517727 
Q-101971 
I14-37636 
C10H9NO2 
5-Methyl-indole-3-carboxylic acid 
5-Methylindole-3-carboxylic acid methyl ester 
ACMC-1BZDW 
3-carboxy-5-methylindole 
5-methylindole-3-formic acid 
SCHEMBL3976054 
CTK0H3847 
Literature
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