151838-62-9

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• Basic information

  1. Product Name: N-(TERT-BUTOXYCARBONYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID
  2. Synonyms: 2-N-BOC-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID;N-(TERT-BUTOXYCARBONYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID;(RS)-1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid, N-BOC protected;2,3(1H)-Isoquinolinedicarboxylic acid, 3,4-dihydro-, 2-(1,1-dimethylethyl) ester (9CI);2,3(1H)-Isoquinolinedicarboxylic acid, 3,4-dihydro-, 2-(1,1-diMethylethyl) ester;N-Boc-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid;Boc-DL-Tic-OH;1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid, N-BOC protected
  3. CAS NO:151838-62-9
  4. Molecular Formula: C₁₅H₁₉NO₄
  5. Molecular Weight: 277.32
  6. EINECS: N/A
  7. Product Categories: N/A
  8. Mol File: 151838-62-9.mol
  9. Article Data: 16

• Chemical Properties

  1. Melting Point: 125-126
  2. Boiling Point: 437.6°Cat760mmHg
  3. Flash Point: 218.5°C
  4. Appearance: /
  5. Density: 1.222g/cm³
  6. Vapor Pressure: 1.97E-08mmHg at 25°C
  7. Refractive Index: 1.556
  8. Storage Temp.: 2-8°C
  9. Solubility: N/A
  10. PKA: 3.88±0.20(Predicted)
  11. CAS DataBase Reference: N-(TERT-BUTOXYCARBONYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID(CAS DataBase Reference)
  12. NIST Chemistry Reference: N-(TERT-BUTOXYCARBONYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID(151838-62-9)
  13. EPA Substance Registry System: N-(TERT-BUTOXYCARBONYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID(151838-62-9)

• Safety Data

  1. Hazard Codes: Xi
  2. Statements: N/A
  3. Safety Statements: N/A
  4. WGK Germany:
  5. RTECS:
  6. HazardClass: N/A
  7. PackingGroup: N/A
  8. Hazardous Substances Data: 151838-62-9(Hazardous Substances Data)

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• 2-(TERT-BUTOXYCARBONYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID

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• 2,3(1H)-Isoquinolinedicarboxylic acid,3,4-dihydro-,2-(1,1-dimethylEthyl) ester(9CI)

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• N-(tert-Butoxycarbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylicacid

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151838-62-9 Usage

General Description

N-(tert-butoxycarbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid is a chemical compound that belongs to the family of isoquinoline carboxylic acids. It is a derivative of tetrahydroisoquinoline, which is a structural motif found in various natural products and pharmaceutical compounds. The tert-butoxycarbonyl group is a protective group often used in organic synthesis to temporarily mask reactive functional groups. N-(TERT-BUTOXYCARBONYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID has potential applications in medicinal chemistry and drug discovery as a building block for the synthesis of novel bioactive compounds. Its unique structure and reactivity make it a valuable intermediate in organic synthesis.

Check Digit Verification of cas no

The CAS Registry Mumber 151838-62-9 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,5,1,8,3 and 8 respectively; the second part has 2 digits, 6 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 151838-62:
(8*1)+(7*5)+(6*1)+(5*8)+(4*3)+(3*8)+(2*6)+(1*2)=139
139 % 10 = 9
So 151838-62-9 is a valid CAS Registry Number.

InChI:InChI=1/C15H19NO4/c1-15(2,3)20-14(19)16-9-11-7-5-4-6-10(11)8-12(16)13(17)18/h4-7,12H,8-9H2,1-3H3,(H,17,18)

151838-62-9SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name	2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

1.2 Other means of identification

Product number	-
Other names	Boc-L-Tic-OH

1.3 Recommended use of the chemical and restrictions on use

Identified uses	For industry use only.
Uses advised against	no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number	-
Service hours	Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:151838-62-9 SDS

151838-62-9Upstream product

• 24424-99-5 di-tert-butyl dicarbonate 
• 41994-51-8 1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid ; hydrochloride 
• 67123-97-1 (R,S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid 
• 551962-90-4 [1,2,3,4]-tetrahydroisoquinoline-2-carboxylic acid 
• 143767-55-9 dimethyl 2-acetyl-1,2,3,4-tetrahydroisoquinoline-3,3-dicarboxylate 
• 612-12-4 o-Xylylene dichloride 
• 143767-54-8 (R,S)-2-acetyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid 
• 594838-55-8 C₂₅H₃₈N₂O₆Si 
• 594838-53-6 2-tert-butoxycarbonylamino-3-(2-cyano-phenyl)-propionic acid 2-trimethylsilanyl-ethyl ester 
• 22115-41-9 2-(bromomethyl)benzonitrile 
• 594838-58-1 C₂₀H₂₆N₂O₆ 
• 226924-21-6 2-tert-butoxycarbonylamino-3-(2-cyanophenyl)propionic acid 
• 58632-95-4 2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile 

151838-62-9Downstream Products

• 439287-42-0 3-(2,6-dimethyl-phenylcarbamoyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester 
• 862506-62-5 (+/-)-N-(tert-butoxycarbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid (4-chlorophenyl)amide 
• 243858-66-4 N-tert-butyloxycarbonyl-1,2,3,4-tetrahydroisoquinoline-3-methanol 
• 104668-15-7 N-(tert-butoxycarbonyl)-1,2,3,4-tetrahydroisoquinoline-3(S)-carbaldehyde 
• 494847-53-9 5-[(2-tert-Butoxycarbonyl-1,2,3,4-tetrahydro-isoquinoline-3-carbonyl)-amino]-isophthalic acid dibenzyl ester 

151838-62-9Relevant articles and documents

Discovery of small-molecule nonpeptide antagonists of nociceptin/orphanin FQ receptor: The studies of design, synthesis, and structure-Activity relationships for (4-Arylpiperidine substituted-methyl)-[bicyclic (hetero)cycloalkanobenzene] derivatives

Hayashi, Shigeo,Ohashi, Katsuyo,Mihara, Sachiko,Nakata, Eriko,Emoto, Chie,Ohta, Atsuko

, p. 345 - 364 (2016/04/19)

Nociceptin/orphanin FQ (N/OFQ) and N/OFQ peptide (NOP) receptor are expressed and distributed in various regions such as central nervous system (CNS), peripheral nervous system, immune system, and peripheral tissues. N/OFQ and NOP receptor have important

Collection of traceable compounds and uses thereof

-

, (2010/07/06)

The use of a collection of compounds of general formula (I), wherein: n is 0 or 1; p represents an integer between 1 and 6; r represents an integer between 1 and 12; R1 and R′1 represent in particular a hydrogen atom; R2 represents an amino acid side chain or an amino acid derivative; R3 represents a group derived from a carboxylic acid, bearing a basic entity; R4 represents in particular an alkyl group containing 1 to 10 carbon atoms; and A represents a hydrogen atom, a protecting group or a tracing group, in particular a fluorophor, a coloring agent or a quencher, for determining, through binding studies, ligands of receptors whose ligand is unknown or whose ligand useful for carrying out specific affinity binding assays is unknown.

TETRAHYDROISOQUINOLINE COMPOUND AND MEDICINAL USE THEREOF

-

Page/Page column 26, (2010/11/28)

The present invention provide a tetrahydroisoquinoline compound having a superior ACAT-inhibitory activity and/or anti-oxidation action, particularly, novel compound represented by the formula (I) (wherein each symbol is as described in the specification) and a pharmaceutically acceptable salt thereof.

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