2-Bromoquinazoline - CAS 1316275-31-6

Catalog:	BB061893
Product Name:	2-Bromoquinazoline
CAS:	1316275-31-6
Synonyms:	2-bromoquinazoline; Quinazoline, 2-bromo-

Technical Data

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Computed Properties

IUPAC Name:	2-bromoquinazoline
Molecular Weight:	209.04
Molecular Formula:	C8H5N2Br
Canonical SMILES:	C1=CC=C2C(=C1)C=NC(=N2)Br
InChI:	InChI=1S/C8H5BrN2/c9-8-10-5-6-3-1-2-4-7(6)11-8/h1-5H
InChI Key:	ZHQSBSGAHYOIQE-UHFFFAOYSA-N

Publication Number	Title	Priority Date
WO-2021151062-A1	Heterocyclic compounds and uses thereof	20200124
CN-113024435-A	Linbicyclic structure sigma-1 receptor inhibitors	20191209
CN-110590770-A	Triazolopyridine-based organic electroluminescent material and organic electroluminescent device	20190822
CN-110590770-B	Triazolopyridine-based organic electroluminescent material and organic electroluminescent device	20190822
CN-110357852-A	Benzo pyridine compound, preparation method and purposes	20190621
CN-108358922-A	A kind of OLED material of the structure of phenanthridines containing naphtho- and its application	20171215
KR-20190043741-A	Hetero-cyclic compound and organic light emitting device using the same	20171019
WO-2019078636-A1	Heterocyclic compounds and organic light emitting devices using the same	20171019
CN-108640928-A	Quinazoline compounds as EGFR inhibitor	20161230
CN-108640928-B	Quinazoline compounds as EGFR inhibitor	20161230

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	140
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	207.96361
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	207.96361
Rotatable Bond Count:	0
Topological Polar Surface Area:	25.8Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7