CAS 2216-93-5 Nirvanol (HCID 91480)

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Basic information

CAS: 2216-93-5
Standard SMILES: CCC1(c2ccccc2)NC(=O)NC1=O
InChIKey: UDTWZFJEMMUFLC-UHFFFAOYSA-N
Molecular formula: C11H12N2O2
Average molar mass: 204.22 g/mol

Overview

Nirvanol is an imidazolidine-2,4-dione.

Names & identifiers

Preferred name: Nirvanol
IUPAC: 5-ethyl-5-phenylimidazolidine-2,4-dione
English name: 2,4-Imidazolidinedione, 5-ethyl-5-phenyl-, (+-)-
Molecular weight: 0

Names & synonyms

Nirvanol631-07-2Ethylphenylhydantoinnormephenytoin5-Phenyl-5-ethylhydantoinHydantoin, 5-ethyl-5-phenyl-desmethylmephenytoin2,4-Imidazolidinedione, 5-ethyl-5-phenyl-23SM1FA1AKDTXSID80874185NSC-33388NSC-150466

Show more names

Nsc 33388

RefChem:596795DTXCID301009622211-150-35-ethyl-5-phenylimidazolidine-2,4-dione5-Ethyl-5-phenylhydantoinrac N-Desmethyl Mephenytoin5-Ethyl-5-phenyl-2,4-imidazolidinedioneNSC 150466

Database identifiers

CAS: 2216-93-5、631-07-2
PubChem CID: 91480
DTXSID: DTXSID80874185
ChEMBL: CHEMBL1438
ChEBI: CHEBI:79441
UNII: 23SM1FA1AK
EC Number: 211-150-3
Nikkaji: J66.258E、J9.448J

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 58.2 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 15
Formal charge: 0
Complexity: 284

Experimental & physicochemical properties

LogP1.53

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.