(1S,2R,7aR)-2,3,5,7a-Tetrahydro-7-(hydroxymethyl)-1H-pyrrolizine-1,2-diol

CAS Registry Number®

5096-50-4

CAS Name

(1S,2R,7aR)-2,3,5,7a-Tetrahydro-7-(hydroxymethyl)-1H-pyrrolizine-1,2-diol

Molecular Formula

C8H13NO3

Molecular Mass

171.19

Cite this Page

(1S,2R,7aR)-2,3,5,7a-Tetrahydro-7-(hydroxymethyl)-1H-pyrrolizine-1,2-diol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5096-50-4 (retrieved 2024-11-22) (CAS RN: 5096-50-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    188-190 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C8H13NO3/c10-4-5-1-2-9-3-6(11)8(12)7(5)9/h1,6-8,10-12H,2-4H2/t6-,7-,8-/m1/s1

InChIKey

InChIKey=VMWCRDCGNVMCGJ-BWZBUEFSSA-N

SMILES

C(O)C=1[C@]2(N(C[C@@H](O)[C@H]2O)CC1)[H]

Canonical SMILES

OCC1=CCN2CC(O)C(O)C12

Other Names for this Substance

  • 1H-Pyrrolizine-1,2-diol, 2,3,5,7a-tetrahydro-7-(hydroxymethyl)-, (1S,2R,7aR)-
  • Crotanecine
  • 1H-Pyrrolizine-1,2-diol, 2,3,5,7a-tetrahydro-7-(hydroxymethyl)-, [1S-(1α,2α,7aβ)]-
  • (1S,2R,7aR)-2,3,5,7a-Tetrahydro-7-(hydroxymethyl)-1H-pyrrolizine-1,2-diol
  • (+)-Crotanecine

View All

Deleted or Replaced CAS Registry Numbers

1349-55-9

CAS INSIGHTSTM
Hourglass and a clock