2-Chloro-7-methoxyquinazoline - CAS 953039-15-1

Catalog:	BB044445
Product Name:	2-Chloro-7-methoxyquinazoline
CAS:	953039-15-1
Synonyms:	2-chloro-7-methoxymethoxy-10H-phenothiazin-3-ol; Quinazoline, 2-chloro-7-methoxy-

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	2-chloro-7-methoxyquinazoline
Description:	2-Chloro-7-methoxyquinazoline (CAS# 953039-15-1 ) is a useful research chemical.
Molecular Weight:	194.62
Molecular Formula:	C9H7ClN2O
Canonical SMILES:	COC1=CC2=NC(=NC=C2C=C1)Cl
InChI:	InChI=1S/C9H7ClN2O/c1-13-7-3-2-6-5-11-9(10)12-8(6)4-7/h2-5H,1H3
InChI Key:	AYOXOMXNWRXDGY-UHFFFAOYSA-N
Boiling Point:	228.6±23.0 °C at 760 mmHg
Purity:	≥ 97 % by HPLC
Density:	1.3±0.1 g/cm³

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Related Functional Groups

Halides

[134005-20-2]
(Z)-1,3-Diiodo-2-butene
[1106917-71-8]
[3-(Difluoromethoxy)phenyl]methanamine hydrochloride
[1855911-19-1]
1-(4-Bromo-2-ethylpyrazol-3-yl)-N-methylmethanamine hydrochloride
[1448610-48-7]
1-(4-Bromo-3-methylphenyl)cyclobutanol
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[1431970-24-9]
2,2-Difluoro-N-[1-(1-methylpyrazol-4-yl)ethyl]ethanamine hydrochloride

Oxygen Compounds

[52378-69-5]
Diethyl trans-cinnamylphosphonate
[5896-75-3]
(Z)-N-(4-Phenylpiperazin-1-yl)-1-(2,3,4-trimethoxyphenyl)methanimine
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[5416-55-7]
2,2,6,6-Tetrakis(hydroxymethyl)cyclohexanol
[37503-42-7]
2-Hydroxyethyl bicyclo[2.2.1]hept-5-ene-2-carboxylate

Quinazolines

[199114-62-0]
2-(Chloromethyl)-3-methylquinazolin-4(3H)-one
[959236-83-0]
8-(Trifluoromethoxy)quinazoline-2,4(1H,3H)-dione
[267243-68-5]
Intermediate 2 of Canertinib
[58421-80-0]
4-Chloro-8-methylquinazoline
[67092-21-1]
2,5,6-Trichloroquinazoline
[27631-29-4]
2,4-Dichloro-6,7-dimethoxyquinazoline

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501
Signal Word:	Warning

Complexity:	179
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	194.0246905
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	194.0246905
Rotatable Bond Count:	1
Topological Polar Surface Area:	35
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.5