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2-(4-Methoxyphenyl)-2-methylpropanenitrile

2-(4-Methoxyphenyl)-2-methylpropanenitrile structure

CAS No:
5351-07-5
Formula:
C11H13NO
Chemical Name:
2-(4-Methoxyphenyl)-2-methylpropanenitrile
Synonyms:
2-(4-methoxyphenyl)-2-methylpropanenitrile;2-(4-methoxy-phenyl)-2-methyl-propionitrile;NSC98;SCHEMBL989065;NSC-98;CTK4J8277;DTXSID50276955;ZINC393280;KS-00000ED2;7620AB
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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2-(4-Methoxyphenyl)-2-methylpropanenitrile Basic Attributes

Molecular Weight：

175.231

Exact Mass：

175.10000

NSC Number：

DSSTox ID：

DTXSID50276955

HScode：

2926909090

Characteristics

PSA：

XLogP3：

2.49638

Density：

1.009g/cm3

Boiling Point：

284.9ºC at 760mmHg

Flash Point：

119.8ºC

Refractive Index：

1.502

Safety Information

Precautionary statement(s)：

P264, P270, P301+P312, P330, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:175.23
XLogP3:2.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:175.099714038
Monoisotopic Mass:175.099714038
Topological Polar Surface Area:33
Heavy Atom Count:13
Complexity:205
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Synthesis Route

Latest News on 2-(4-Methoxyphenyl)-2-methylpropanenitrile

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Guide of 2-(4-Methoxyphenyl)-2-methylpropanenitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties
Synthesis Route
Latest News
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