(-)-Atropine
CAS Registry Number®
101-31-5
CAS Name
(-)-AtropineMolecular Formula
C17H23NO3Molecular Mass
289.37Cite this Page
(-)-Atropine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=101-31-5 (retrieved ) (CAS RN: 101-31-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
108.5 °C
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
Other Names and Identifiers
InChI
InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15+,16-/m1/s1
InChIKey
InChIKey=RKUNBYITZUJHSG-FXUDXRNXSA-N
SMILES
O(C([C@H](CO)C1=CC=CC=C1)=O)[C@@H]2C[C@]3(N(C)[C@@](C2)(CC3)[H])[H]
Canonical SMILES
O=C(OC1CC2N(C)C(CC2)C1)C(C=3C=CC=CC3)CO
Other Names for this Substance
- Benzeneacetic acid, α-(hydroxymethyl)-, (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, (αS)-
- 1αH,5αH-Tropan-3α-ol, (-)-tropate (ester)
- Benzeneacetic acid, α-(hydroxymethyl)-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, [3(S)-endo]-
- Tropic acid, 1αH,5αH-tropan-3α-yl ester, (-)-
- (-)-Atropine
Deleted or Replaced CAS Registry Numbers
1892-81-5, 8000-07-5, 28905-40-0, 38411-64-2, 47170-56-9, 1891070-00-0