Home Indole and Oxindoles 1504-06-9
1504-06-9,MFCD04037370
Catalog No.:AA001MIC

1504-06-9 | 3-Methyloxindole

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250mg
97%
in stock  
$12.00   $8.00
- +
1g
97%
in stock  
$17.00   $12.00
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5g
97%
in stock  
$57.00   $40.00
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10g
97%
in stock  
$105.00   $74.00
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25g
98%
in stock  
$246.00   $173.00
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100g
98%
in stock  
$800.00   $560.00
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500g
98%
in stock  
$3,622.00   $2,535.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA001MIC
Chemical Name:
3-Methyloxindole
CAS Number:
1504-06-9
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
MDL Number:
MFCD04037370
SMILES:
O=C1Nc2c(C1C)cccc2
Properties
Properties
 
BP:
279.3°C at 760 mmHg  
Form:
Solid  
MP:
117-121 °C(lit.)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
178  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.3  

Literature

Title: Respective roles of CYP2A5 and CYP2F2 in the bioactivation of 3-methylindole in mouse olfactory mucosa and lung: studies using Cyp2a5-null and Cyp2f2-null mouse models.

Journal: Drug metabolism and disposition: the biological fate of chemicals 20120401

Title: The pneumotoxin 3-methylindole is a substrate and a mechanism-based inactivator of CYP2A13, a human cytochrome P450 enzyme preferentially expressed in the respiratory tract.

Journal: Drug metabolism and disposition: the biological fate of chemicals 20091001

Title: Porcine CYP2A19, CYP2E1 and CYP1A2 forms are responsible for skatole biotransformation in the reconstituted system.

Journal: Neuro endocrinology letters 20090101

Title: Unbiased high-throughput screening of reactive metabolites on the linear ion trap mass spectrometer using polarity switch and mass tag triggered data-dependent acquisition.

Journal: Analytical chemistry 20080815

Title: Palladium-catalyzed alpha-vinylation of carbonyl compounds.

Journal: Organic letters 20071011

Title: Metabolism and bioactivation of 3-methylindole by human liver microsomes.

Journal: Chemical research in toxicology 20070101

Title: The role of CYP2A and CYP2E1 in the metabolism of 3-methylindole in primary cultured porcine hepatocytes.

Journal: Drug metabolism and disposition: the biological fate of chemicals 20060501

Title: Phase II in vitro metabolism of 3-methylindole metabolites in porcine liver.

Journal: Xenobiotica; the fate of foreign compounds in biological systems 20030501

Title: Selective dehydrogenation/oxygenation of 3-methylindole by cytochrome p450 enzymes.

Journal: Drug metabolism and disposition: the biological fate of chemicals 20010701

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SDS
Tags:1504-06-9 Molecular Formula|1504-06-9 MDL|1504-06-9 SMILES|1504-06-9 3-Methyloxindole |Heterocyclic_Building_Blocks