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4-(1,1-Dimethylethyl)-2-(1-methylpropyl)phenol

4-(1,1-Dimethylethyl)-2-(1-methylpropyl)phenol structure

CAS No:
51390-14-8
Formula:
C14H22O
Chemical Name:
4-(1,1-Dimethylethyl)-2-(1-methylpropyl)phenol
Synonyms:
Phenol,4-(1,1-dimethylethyl)-2-(1-methylpropyl)-;4-(1,1-Dimethylethyl)-2-(1-methylpropyl)phenol;2-sec-Butyl-4-tert-butylphenol;2-(Butan-2-yl)-4-tert-butylphenol

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4-(1,1-Dimethylethyl)-2-(1-methylpropyl)phenol Basic Attributes

Molecular Weight：

206.32400

Exact Mass：

206.32

EC Number：

421-740-4

DSSTox ID：

DTXSID20335588

Characteristics

PSA：

20.23000

XLogP3：

4.20320

Safety Information

hazard class code：

R34

safety instructions：

S26; S36/37/39; S45; S61

Marks：

C; N

GHS Classification：

|Danger|H314: Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P273, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P391, P405, and P501

Computed Properties

Molecular Weight:206.32
XLogP3:4.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:206.167065321
Monoisotopic Mass:206.167065321
Topological Polar Surface Area:20.2
Heavy Atom Count:15
Complexity:192
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(1,1-Dimethylethyl)-2-(1-methylpropyl)phenol

Basic Attributes
Characteristics
Safety Information
Computed Properties

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