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2,6-Dimethyl-3-nitrophenol

2,6-Dimethyl-3-nitrophenol structure

CAS No:
6994-63-4
Formula:
C8H9NO3
Chemical Name:
2,6-Dimethyl-3-nitrophenol
Synonyms:
Phenol,2,6-dimethyl-3-nitro-;2,6-Xylenol,3-nitro-;2,6-Dimethyl-3-nitrophenol

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2,6-Dimethyl-3-nitrophenol Basic Attributes

Molecular Weight：

167.16200

Exact Mass：

167.16

EC Number：

230-267-0

DSSTox ID：

DTXSID20220223

HScode：

2908999090

Characteristics

PSA：

66.05000

XLogP3：

2.44040

Density：

1.263g/cm3

Melting Point：

99-100 °C @ Solvent: Benzene

Boiling Point：

292.4ºC

Flash Point：

129.9ºC

Refractive Index：

1.585

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:167.16
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:167.058243149
Monoisotopic Mass:167.058243149
Topological Polar Surface Area:66
Heavy Atom Count:12
Complexity:178
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,6-Dimethyl-3-nitrophenol

Basic Attributes
Characteristics
Safety Information
Computed Properties

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