6-Chloroquinazolin-2(1H)-one - CAS 60610-12-0

Catalog:	BB044457
Product Name:	6-Chloroquinazolin-2(1H)-one
CAS:	60610-12-0
Synonyms:	2(1H)-Quinazolinone, 6-chloro-; 6-Chloro-2-hydroxyquinazoline; 6-Chloro-2(1h)-quinazolinone

Technical Data

Computed Properties

IUPAC Name:	6-chloro-1H-quinazolin-2-one
Description:	6-Chloroquinazolin-2(1H)-one (CAS# 60610-12-0 ) is a useful research chemical.
Molecular Weight:	180.59
Molecular Formula:	C8H5ClN2O
Canonical SMILES:	C1=CC2=C(C=C1Cl)C=NC(=O)N2
InChI:	InChI=1S/C8H5ClN2O/c9-6-1-2-7-5(3-6)4-10-8(12)11-7/h1-4H,(H,10,11,12)
InChI Key:	MMIZUUJBTRUHNH-UHFFFAOYSA-N
Melting Point:	>300 °C
Purity:	98 %
Density:	1.50±0.1 g/cm³ (Predicted)

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[17746-05-3]
Undecanoyl chloride
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-

Halides

[1106917-71-8]
[3-(Difluoromethoxy)phenyl]methanamine hydrochloride
[1855911-19-1]
1-(4-Bromo-2-ethylpyrazol-3-yl)-N-methylmethanamine hydrochloride
[444581-46-8]
1-Bromo-2-(1,1-difluoroethyl)benzene
[1431966-58-3]
2,2-Difluoro-N-(2-morpholin-4-ylethyl)ethanamine dihydrochloride
[4185-62-0]
2-Bromo-1-nitronaphthalene
[712347-12-1]
3-(2-Chloro-6-fluorophenyl)-4,5-dihydroisoxazole-5-carboxylic acid

Quinazolines

[199114-62-0]
2-(Chloromethyl)-3-methylquinazolin-4(3H)-one
[20197-97-1]
2-Chloro-6-methoxyquinazolin-4(3H)-one
[119-24-4]
Folic Acid EP Impurity D (Methotrexate EP Impurity D)
[202475-65-8]
N-(3,4-dimethoxyphenyl)-6,7-dimethoxyquinazolin-4-amine
[21599-37-1]
2-Amino-7,7-dimethyl-7,8-dihydroquinazolin-5(6H)-one
[1172851-61-4]
4-Chloro-6-iodo-7-methoxyquinazoline

Complexity:	229
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	180.0090405
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	180.0090405
Rotatable Bond Count:	0
Topological Polar Surface Area:	41.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3