6-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1,3-benzoxazin-4-one

HCID 13754331CAS 74469-70-8

Substructure search Find similar structures

Basic information

Standard SMILES: CC1(C)NC(=O)c2cc(O)ccc2O1
InChIKey: VNTPFMOUPGCKFE-UHFFFAOYSA-N
Molecular formula: C10H11NO3
Average molar mass: 193.2 g/mol

Names & identifiers

Preferred name: 6-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1,3-benzoxazin-4-one
IUPAC: 6-hydroxy-2,2-dimethyl-3H-1,3-benzoxazin-4-one

Names & synonyms

74469-70-86-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1,3-benzoxazin-4-oneRefChem:543348878-438-46-Hydroxy-2,2-dimethyl-2H-benzo[e][1,3]oxazin-4(3H)-one2,3-dihydro-2,2-dimethyl-6-hydroxy-4H-1,3-benzoxazin-4-oneSCHEMBL10712890VNTPFMOUPGCKFE-UHFFFAOYSA-NMFCD24551383SY488500EN300-87827662,3-dihydro-2,2-dimethyl-6-hydroxy-4H-1,3-benzoxazine-4-one

Show more names

6-Hydroxy-2,2-dimethyl-2,3-dihydro-4H-benzo[e][1,3]oxazin-4-one

Database identifiers

CAS: 74469-70-8
PubChem CID: 13754331
EC Number: 878-438-4

Properties

Computed structural properties

XLogP: 1.3
Topological polar surface area: 58.6 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 0
Heavy atoms: 14
Formal charge: 0
Complexity: 252

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)

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