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1-(4-Hydroxy-2,6-diMethylphenyl)ethanone

1-(4-Hydroxy-2,6-diMethylphenyl)ethanone structure

CAS No:
91060-92-3
Formula:
C10H12O2
Chemical Name:
1-(4-Hydroxy-2,6-diMethylphenyl)ethanone
Synonyms:
1-(4-Hydroxy-2,6-diMethylphenyl)ethanone;1-(4-hydroxy-2,6-dimethylphenyl)ethan-1-one;Ethanone, 1-(4-hydroxy-2,6-dimethylphenyl)-

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1-(4-Hydroxy-2,6-diMethylphenyl)ethanone Basic Attributes

Molecular Weight：

164.2

Exact Mass：

164.083729621

DSSTox ID：

DTXSID40398857

Characteristics

PSA：

37.30000

XLogP3：

2.21160

Density：

1.080±0.06 g/cm3

Melting Point：

150-151 °C

Boiling Point：

317.3±37.0 °C(Predicted)

PKA：

8.41±0.23

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:164.20
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:164.083729621
Monoisotopic Mass:164.083729621
Topological Polar Surface Area:37.3
Heavy Atom Count:12
Complexity:165
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(4-Hydroxy-2,6-diMethylphenyl)ethanone

Basic Attributes
Characteristics
Safety Information
Computed Properties

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