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2-Methoxy-1-naphthalenecarbonitrile

2-Methoxy-1-naphthalenecarbonitrile structure

CAS No:
16000-39-8
Formula:
C12H9NO
Chemical Name:
2-Methoxy-1-naphthalenecarbonitrile
Synonyms:
1-Naphthalenecarbonitrile,2-methoxy-;1-Naphthonitrile,2-methoxy-;2-Methoxy-1-naphthalenecarbonitrile;2-Methoxy-1-naphthonitrile;1-Cyano-2-methoxynaphthalene;NSC 94825

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2-Methoxy-1-naphthalenecarbonitrile Basic Attributes

Molecular Weight：

183.20600

Exact Mass：

183.21

EC Number：

240-133-3

NSC Number：

94825

DSSTox ID：

DTXSID70166783

HScode：

2926909090

Characteristics

PSA：

33.02000

XLogP3：

2.72008

Appearance：

white to brown crystals or crystalline powder

Density：

1.16g/cm3

Melting Point：

94-96 °C

Boiling Point：

362.8ºC

Flash Point：

153ºC

Refractive Index：

1.622

Vapor Pressure：

1.89E-05mmHg at 25°C

Safety Information

wgk germany：

hazard class code：

R20/21/22

safety instructions：

S36

Marks：

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|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:183.21
XLogP3:2.9
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:183.068413911
Monoisotopic Mass:183.068413911
Topological Polar Surface Area:33
Heavy Atom Count:14
Complexity:242
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Methoxy-1-naphthalenecarbonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

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