Phenol, 3-(2-aminopropyl)-, (S)-, (2R,3R)-2,3-dihydroxybutanedioate (2:1) (salt)

CAS Registry Number®

66068-90-4

CAS Name

Phenol, 3-(2-aminopropyl)-, (S)-, (2R,3R)-2,3-dihydroxybutanedioate (2:1) (salt)

Molecular Formula

C9H13NO.1/2C4H6O6

Cite this Page

Phenol, 3-(2-aminopropyl)-, (S)-, (2R,3R)-2,3-dihydroxybutanedioate (2:1) (salt).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=66068-90-4 (retrieved 2024-11-22) (CAS RN: 66068-90-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H13NO.C4H6O6/c1-7(10)5-8-3-2-4-9(11)6-8;5-1(3(7)8)2(6)4(9)10/h2-4,6-7,11H,5,10H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t7-;1-,2-/m01/s1

InChIKey

InChIKey=HJPBPLXHJQUYOG-QXJKSQRWSA-N

SMILES

C([C@H](C)N)C1=CC(O)=CC=C1.[C@@H]([C@H](C(O)=O)O)(C(O)=O)O

Canonical SMILES

O=C(O)C(O)C(O)C(=O)O.OC1=CC=CC(=C1)CC(N)C

Other Names for this Substance

  • Phenol, 3-(2-aminopropyl)-, (S)-, (2R,3R)-2,3-dihydroxybutanedioate (2:1) (salt)
  • Phenol, 3-(2-aminopropyl)-, (S)-, [R-(R*,R*)]-2,3-dihydroxybutanedioate (2:1) (salt)