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CAS Number: 115962-35-1
(R)-2-(tert-butoxycarbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid

Structure

(R)-2-(tert-butoxycarbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
Name: (R)-2-(tert-butoxycarbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
Synonyms:
General Information
Product Number: 115962351
CAS Number:
115962-35-1
Name:
(R)-2-(tert-butoxycarbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
Chemical Formula: C15H19NO4
Molecular Weight: 277.32
Synonyms:
2,3(1H)-Isoquinolinedicarboxylicacid, 3,4-dihydro-, 2-(1,1-dimethylethyl) ester, (R)-;(3R)-2-(tert-Butoxycarbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid;(R)-2-((tert-Butoxy)carbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid;(R)-N-(tert-Butyloxycarbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid;2-BOC-D-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid;
InChI: InChI=1S/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)/t12-/m1/s1
InChIKey: HFPVZPNLMJDJFB-GFCCVEGCSA-N
Canonical SMILES : CC(C)(C)OC(=O)N1CC2=CC=CC=C2CC1C(=O)O
 
Optical and Scattering Properties Value Condition Note
Optical Rotatory Power -18.6 ° Conc: 1.00 g/100mL; Solv: methanol (67-56-1); Temp: 20 °C (2)IC
Optical Rotatory Power -18.9 ° Conc: 1.00 g/100mL; Solv: methanol (67-56-1); Temp: 20 °C

(3)IC

 

Thermal Properties Value Condition Note
Melting Point 122-123 °C   (2)IC
Melting Point 76-80 °C   (1)CAS

Specification

98%

References
  1. (1) Liu, Keliang; CN 1467219 A 2004 CAPLUS
  2. (2) Kazmierski, Wieslaw; Tetrahedron 1988, V44(3), P697-710 CAPLUS
  3. (3) Hruby, Victor J.; Collection of Czechoslovak Chemical Communications 1988, V53(11A), P2549-73 CAPLUS
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