CAS 23441-75-0 2(1H)-Quinazolinone, 4-phenyl- (HCID 63430)

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Basic information

CAS: 23441-75-0
Standard SMILES: O=c1nc(-c2ccccc2)c2ccccc2[nH]1
InChIKey: FHUBTSLLILWICW-UHFFFAOYSA-N
Molecular formula: C14H10N2O
Average molar mass: 222.24 g/mol
Monoisotopic mass: 222.07931295

Names & identifiers

Preferred name: 2(1H)-Quinazolinone, 4-phenyl-
IUPAC: 4-phenyl-1H-quinazolin-2-one
English name: 4-phenylquinazolin-2(1H)-one
Molecular formula: C14H10N2O
Molecular weight: 222.24

Names & synonyms

2(1H)-Quinazolinone, 4-phenyl-4-Phenyl-2(1H)-quinazolinoneBRN 0171247DTXSID701779955-24-04-00247 (Beilstein Handbook Reference)RefChem:241356DTXCID301004864-phenylquinazolin-2(1H)-one23441-75-04-Phenyl-1H-quinazolin-2-one4-phenyl-2,3-dihydroquinazolin-2-one4-phenyl-2-quinazolinol

Show more names

MFCD002214814-phenyl-1,2-dihydroquinazolin-2-oneCHEMBL15889164-phenylquinazolin-2-olMaybridge1_0089864-phenylquinazolin-2-oneMixCom3_000120MLS000070504

Database identifiers

CAS: 23441-75-0
PubChem CID: 63430
DTXSID: DTXSID70177995
ChEMBL: CHEMBL1588916
EC Number: 108-359-6
Nikkaji: J1.606.845D

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 41.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 17
Formal charge: 0
Complexity: 331

Physicochemical properties

Melting point: 254 · 254 - 257°C
storage temp.: -20 °C, · -20°C, Inert atmosphere
solubility: DMSO (Slightly), Methanol (Slightly)
form: Solid
color: Off-White to Light Beige

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.