2,5-Dibromopyrazine - CAS 23229-26-7

Catalog:	BB017984
Product Name:	2,5-Dibromopyrazine
CAS:	23229-26-7
Synonyms:	2,5-dibromopyrazine; 2,5-dibromopyrazine

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Computed Properties

IUPAC Name:	2,5-dibromopyrazine
Description:	2,5-Dibromopyrazine (CAS# 23229-26-7) is a useful research chemical.
Molecular Weight:	237.88
Molecular Formula:	C4H2Br2N2
Canonical SMILES:	C1=C(N=CC(=N1)Br)Br
InChI:	InChI=1S/C4H2Br2N2/c5-3-1-7-4(6)2-8-3/h1-2H
InChI Key:	KIYKHEOWZLJZSB-UHFFFAOYSA-N
Boiling Point:	234.044 °C at 760 mmHg
Density:	2.197 g/cm³
MDL:	MFCD08061601
LogP:	2.00160

Publication Number	Title	Priority Date
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GHS Hazard Statement:	H302 (93.18%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	68.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	237.85642
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	235.85847
Rotatable Bond Count:	0
Topological Polar Surface Area:	25.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8