1-(CYANOMETHYL)-1H-INDOLE-2-CARBOXYLIC ACID

Modify Date: 2025-08-25 15:41:03

1-(CYANOMETHYL)-1H-INDOLE-2-CARBOXYLIC ACID Structure
1-(CYANOMETHYL)-1H-INDOLE-2-CARBOXYLIC ACID structure
Common Name 1-(CYANOMETHYL)-1H-INDOLE-2-CARBOXYLIC ACID
CAS Number 959089-89-5 Molecular Weight 200.19300
Density N/A Boiling Point N/A
Molecular Formula C11H8N2O2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 1-(cyanomethyl)indole-2-carboxylic acid

 Chemical & Physical Properties

Molecular Formula C11H8N2O2
Molecular Weight 200.19300
Exact Mass 200.05900
PSA 66.02000
LogP 1.86308
InChIKey SLQUFVJVTDUONL-UHFFFAOYSA-N
SMILES N#CCn1c(C(=O)O)cc2ccccc21

 Safety Information

HS Code 2933990090

 Synthetic Route

~67%

1-(CYANOMETHYL)-1H-INDOLE-2-CARBOXYLIC ACID Structure

1-(CYANOMETHYL)...

CAS#:959089-89-5

Literature: F. HOFFMANN-LA ROCHE AG Patent: WO2008/68159 A1, 2008 ; Location in patent: Page/Page column 35 ; WO 2008/068159 A1

 Precursor & DownStream

Precursor  1

DownStream  0

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
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