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2,6-ditert-butyl-4-(2,3-dihydro-1H-perimidin-2-yl)phenol

HCID 2864280
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Basic information

CAS
36507-78-5
Standard SMILES
CC(C)(C)c1cc(C2Nc3cccc4cccc(c34)N2)cc(C(C)(C)C)c1O
InChIKey
WBSRWPYIVUJCCR-UHFFFAOYSA-N
Molecular formula
C25H30N2O
Average molar mass
374.5 g/mol
Monoisotopic mass
374.23581359

Names & identifiers

Preferred name
2,6-ditert-butyl-4-(2,3-dihydro-1H-perimidin-2-yl)phenol
IUPAC
2,6-ditert-butyl-4-(2,3-dihydro-1H-perimidin-2-yl)phenol
English name
2,6-ditert-butyl-4-(2,3-dihydro-1H-perimidin-2-yl)phenol
Molecular formula
C25H30N2O
Molecular weight
374.52

Names & synonyms

2,6-ditert-butyl-4-(2,3-dihydro-1H-perimidin-2-yl)phenol36507-78-52,6-di-tert-butyl-4-(2,3-dihydro-1H-perimidin-2-yl)phenolCBMicro_006088Oprea1_102723Oprea1_838578SCHEMBL197170SMSF0007128STK842156AKOS002175350CB08304ST041327
Show more names
Phenol, 4-(2,3-dihydro-1H-perimidin-2-yl)-2,6-bis(1,1-dimethylethyl)-
BIM-0006167.P001AG-690/114808462,6-bis(tert-butyl)-4-(2,3-dihydroperimidin-2-yl)phenol4-(2,3-dihydro-1H-perimidin-2-yl)-2,6-bis(1,1-dimethylethyl)phenol

Database identifiers

CAS
36507-78-5
PubChem CID
2864280
EC Number
118-723-6

Properties

Computed structural properties

XLogP
7.5
Topological polar surface area
44.3 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
28
Formal charge
0
Complexity
504

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/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.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Related reactions

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Compound notes

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