1,8-dibromoisoquinoline, 95%

Name: 1,8-dibromoisoquinoline
Brand: Chempure

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CAS Number

120258-67-5

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About this item

IUPAC name	1,8-dibromoisoquinoline
inchi	InChI=1S/C9H5Br2N/c10-7-3-1-2-6-4-5-12-9(11)8(6)7/h1-5H
inchi key	IKAVUSHDOXOKHX-UHFFFAOYSA-N
molecular formula	C9H5Br2N
synonyms	Isoquinoline, 1,8-dibromo- 120258-67-5 1,8-dibromoisoquinoline Isoquinoline,1,8-dibromo- AT43512

Computed Properties

Molecular Weight:	286.95 g/mol
XLogP3:	3.8
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	1
Rotatable Bond Count:	0
Exact Mass:	286.87682 g/mol
Monoisotopic Mass:	284.87887 g/mol
Topological Polar Surface Area:	12.9 Å²
Heavy Atom Count:	12
Formal Charge:	0
Complexity:	163
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

hazard signal	Danger
hazard classes and categories	Acute Tox. 4 (100%) Skin Irrit. 2 (100%) Eye Dam. 1 (100%) STOT SE 3 (100%)
precautionary statement codes	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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*This document is like a lab demo—an example Certificate of Analysis (COA) that showcases what a COA looks like but may not match the latest batch in all its glory. Think of it as a chemistry experiment: close, but not quite the final reaction!

Product No: BC3671

1,8-dibromoisoquinoline, 95%

Product No: BC3671

About this item

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Product No: BC3671

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?