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2-Chloro-4-methoxy-3-pyridinecarbonitrile

2-Chloro-4-methoxy-3-pyridinecarbonitrile structure

CAS No:
98645-43-3
Formula:
C7H5ClN2O
Chemical Name:
2-Chloro-4-methoxy-3-pyridinecarbonitrile
Synonyms:
3-Pyridinecarbonitrile,2-chloro-4-methoxy-;2-Chloro-4-methoxy-3-pyridinecarbonitrile;2-Chloro-3-cyano-4-methoxypyridine;2-Chloro-4-methoxynicotinonitrile
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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2-Chloro-4-methoxy-3-pyridinecarbonitrile Basic Attributes

Molecular Weight：

168.58

Exact Mass：

168.58

DSSTox ID：

DTXSID90362982

HScode：

2933399090

Characteristics

PSA：

45.9

XLogP3：

1.94

Density：

1.3±0.1 g/cm3

Melting Point：

175-176 °C @ Solvent: Methanol

Boiling Point：

318.3±37.0 °C at 760 mmHg

Flash Point：

146.3±26.5 °C

Refractive Index：

1.550

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

UN2811

hazard class code：

25-37/38-41

safety instructions：

26-39-45

Marks：

Xi,T

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

Hazard Statements：

H302

GHS Classification：

|Danger|H301+H311+H331 (16.67%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 6 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:168.58
XLogP3:1.5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:168.0090405
Monoisotopic Mass:168.0090405
Topological Polar Surface Area:45.9
Heavy Atom Count:11
Complexity:177
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Chloro-4-methoxy-3-pyridinecarbonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties
Latest News
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2-Chloro-4-methoxy-3-pyridinecarbonitrile

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