Home
Random
Nearby
Log in
Settings
Donate
About Wikidata
Disclaimers
Search
(Q82006530)
Watch
English
3-{1-[2-(4-hydroxyphenyl)ethyl]-3-isobutylpyrrolidin-3-yl}phenol hydrochloride hydrate
chemical compound
3-{1-[2-(4-Hydroxyphenyl)ethyl]-3-(2-methylpropyl)pyrrolidin-3-yl}phenol--hydrogen chloride--water (1/1/1)
In more languages
edit
Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
393.20707156399993
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₃₂ClNO₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(C)CC1(c2cccc(O)c2)CCN(CCc2ccc(O)cc2)C1.Cl.O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C22H29NO2.ClH.H2O/c1-17(2)15-22(19-4-3-5-21(25)14-19)11-13-23(16-22)12-10-18-6-8-20(24)9-7-18;;/h3-9,14,17,24-25H,10-13,15-16H2,1-2H3;1H;1H2
0 references
InChIKey
CZFQKEYNHDJKNX-UHFFFAOYSA-N
0 references
CAS Registry Number
65902-80-9
reason for deprecated rank
cannot be confirmed by other sources
0 references
64047-90-1
reason for deprecated rank
cannot be confirmed by other sources
0 references
PubChem CID
115769
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
53534360
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40276161
0 references
DTXSID40982255
0 references
DSSTOX compound identifier
DTXCID10227504
0 references
DTXCID901409519
0 references
Sitelinks
Wikipedia
(0 entries)
edit
Wikibooks
(0 entries)
edit
Wikinews
(0 entries)
edit
Wikiquote
(0 entries)
edit
Wikisource
(0 entries)
edit
Wikiversity
(0 entries)
edit
Wikivoyage
(0 entries)
edit
Wiktionary
(0 entries)
edit
Multilingual sites
(0 entries)
edit
