Gabazine
CAS Registry Number®
104104-50-9
CAS Name
GabazineMolecular Formula
C15H17N3O3.BrHCite this Page
Gabazine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=104104-50-9 (retrieved ) (CAS RN: 104104-50-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
200 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
Other Names and Identifiers
InChI
InChI=1S/C15H17N3O3.BrH/c1-21-12-6-4-11(5-7-12)13-8-9-14(16)18(17-13)10-2-3-15(19)20;/h4-9,16H,2-3,10H2,1H3,(H,19,20);1H
InChIKey
InChIKey=GFZHNFOGCMEYTA-UHFFFAOYSA-N
SMILES
C(CCC(O)=O)N1N=C(C=CC1=N)C2=CC=C(OC)C=C2.Br
Canonical SMILES
Br.O=C(O)CCCN1N=C(C=CC1=N)C=2C=CC(OC)=CC2
Other Names for this Substance
- 1(6H)-Pyridazinebutanoic acid, 6-imino-3-(4-methoxyphenyl)-, hydrobromide (1:1)
- 1(6H)-Pyridazinebutanoic acid, 6-imino-3-(4-methoxyphenyl)-, monohydrobromide
- SR 95531
- Gabazine