2-Vinylpyrazine - CAS 4177-16-6

Catalog:	BB024954
Product Name:	2-Vinylpyrazine
CAS:	4177-16-6
Synonyms:	2-ethenylpyrazine

Technical Data

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Patents

Computed Properties

IUPAC Name:	2-ethenylpyrazine
Description:	2-Vinylpyrazine (CAS# 4177-16-6) is a useful research chemical.
Molecular Weight:	106.13
Molecular Formula:	C6H6N2
Canonical SMILES:	C=CC1=NC=CN=C1
InChI:	InChI=1S/C6H6N2/c1-2-6-5-7-3-4-8-6/h2-5H,1H2
InChI Key:	KANZWHBYRHQMKZ-UHFFFAOYSA-N
Boiling Point:	75-76 °C (30 torr)
Purity:	> 98.0 % (GC)
Density:	1.046 g/cm³
Appearance:	Straw to dark brown liquid
Storage:	Freezer
MDL:	MFCD00051591
LogP:	1.11960

Publication Number	Title	Priority Date
JP-6945096-B1	Adsorbent replacement method and fuel cell system	20210416
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JP-2021050353-A	Adhesive sheet, display body and manufacturing method of display body	20201210

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GHS Hazard Statement:	H226 (33.33%): Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P312, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501
Signal Word:	Danger

Complexity:	80.6
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	106.053098200
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	106.053098200
Rotatable Bond Count:	1
Topological Polar Surface Area:	25.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.6