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3-NITROPYRIDINE

3-NITROPYRIDINE structure

CAS No:
2530-26-9
Formula:
C5H4N2O2
Chemical Name:
3-NITROPYRIDINE
Synonyms:
5-Nitropyridine;3-NITROPYRIDINE;Pyridine,3-nitro-;3-Nitropyridine,98%
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Description

white to yellow needle-like crystals

3-NITROPYRIDINE Basic Attributes

Molecular Weight：

124.1

Exact Mass：

124.027275

BRN：

111969

DSSTox ID：

DTXSID00179947

HScode：

29333999

Characteristics

PSA：

58.7

XLogP3：

0.56

Appearance：

Clear colorless Liquid

Density：

1.3±0.1 g/cm3

Melting Point：

35-40 °C

Boiling Point：

216°C

Flash Point：

216°C

Refractive Index：

1.567

Storage Conditions：

Flammables area

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

2811

wgk germany：

hazard class code：

20/21/22-11-41-37/38-22

safety instructions：

37/39-26-16-39

Marks：

Xn-F,Xn,F

Precautionary statement(s)：

P261-P280-P301 + P310-P305 + P351 + P338

Hazard Statements：

H301-H315-H318-H335

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 46 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

3-NITROPYRIDINE Use and Manufacturing

Used in the novel synthesis of biologically active nitro heterocyclic compounds.

Computed Properties

Molecular Weight:124.10
XLogP3:0.6
Hydrogen Bond Acceptor Count:3
Exact Mass:124.027277375
Monoisotopic Mass:124.027277375
Topological Polar Surface Area:58.7
Heavy Atom Count:9
Complexity:110
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes