CAS Registry Number®
51-55-8
CAS Name
(±)-Atropine
Molecular Formula
C17H23NO3
Molecular Mass
289.37
Compound Properties
-
Melting Point (1)
118.5 °C
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
Other Names and Identifiers
InChI
InChI=1/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?
InChIKey
InChIKey=RKUNBYITZUJHSG-SPUOUPEWNA-N
SMILES
O(C(C(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
- 1αH,5αH-Tropan-3α-ol (±)-tropate (ester)
- Benzeneacetic acid, α-(hydroxymethyl)-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, endo–
- (3-endo)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl α-(hydroxymethyl)benzeneacetate
- dl-Hyoscyamine
- Atropine
- dl-Tropyl tropate
- Tropine (±)-tropate
- Atropin
- (±)-Hyoscyamine
- (±)-Atropine
- DL-Hyoscyamine
- Tropine tropate
- Atropinum sulphuricum
- MeSH ID: D001285
Deleted or Replaced CAS Registry Numbers
78597-12-3, 1445960-43-9
