4-Chloro-7-nitroquinazoline - CAS 19815-17-9

Catalog:	BB015316
Product Name:	4-Chloro-7-nitroquinazoline
CAS:	19815-17-9
Synonyms:	4-chloro-7-nitroquinazoline; 4-chloro-7-nitroquinazoline

Technical Data

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Computed Properties

IUPAC Name:	4-chloro-7-nitroquinazoline
Description:	4-Chloro-7-nitroquinazoline (CAS# 19815-17-9) is a useful research chemical.
Molecular Weight:	209.59
Molecular Formula:	C8H4ClN3O2
Canonical SMILES:	C1=CC2=C(C=C1[N+](=O)[O-])N=CN=C2Cl
InChI:	InChI=1S/C8H4ClN3O2/c9-8-6-2-1-5(12(13)14)3-7(6)10-4-11-8/h1-4H
InChI Key:	CCCGYXZEVXWXAU-UHFFFAOYSA-N
Boiling Point:	379.959 °C at 760 mmHg
Density:	1.567 g/cm³
LogP:	2.71460

Publication Number	Title	Priority Date
CN-113200927-A	Synthesis method of N- (3-ethynylphenyl) -quinazoline-4-amine	20210430
CN-112300141-A	Quinazoline-containing myricetin derivative, and preparation method and application thereof	20201012
WO-2021043245-A1	Hydantoin derivative	20190906
WO-2021011796-A1	Inhibitors of cyclin-dependent kinases	20190717
WO-2020246487-A1	Compounds having dispiro diketopiperazine structure	20190604

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Related Functional Groups

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[199114-62-0]
2-(Chloromethyl)-3-methylquinazolin-4(3H)-one
[19062-39-6]
4(3H)-Quinazolinone, 3-amino-2-hydrazino-
[29113-33-5]
Ethyl 4-quinazolone-2-carboxylate
[37793-53-6]
N10-(Trifluoroacetyl)pteroic acid
[1172851-61-4]
4-Chloro-6-iodo-7-methoxyquinazoline
[58421-80-0]
4-Chloro-8-methylquinazoline

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GHS Hazard Statement:	H301 (97.44%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	233
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	208.9992041
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	208.9992041
Rotatable Bond Count:	0
Topological Polar Surface Area:	71.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3