AG00IIYU

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

AG00IIYU

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CAS Number	953039-15-1
Catalog Number	AG00IIYU(AGN-PC-0ALHPG)
Chemical Name	2-Chloro-7-methoxyquinazoline
IUPAC Name	2-chloro-7-methoxyquinazoline
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
MDL Number	MFCD09907933
Molecular Formula	C9H7ClN2O
Molecular Weight	194.6177
SMILES	COC1=CC2=NC(Cl)=NC=C2C=C1
Synonyms	2-chloro-7-methoxyquinazoline, 953039-15-1, 2-chloro-7-methoxymethoxy-10H-phenothiazin-3-ol, SCHEMBL1633917, AYOXOMXNWRXDGY-UHFFFAOYSA-N, Quinazoline, 2-chloro-7-methoxy-, FCH834690, MFCD09907933, ZINC79065372, AKOS006281595, KS-0000245X, AJ-123090, AX8260944, C95151, CS-4128,

Complexity	179
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	194.025g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	194.618g/mol
Monoisotopic Mass	194.025g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	35A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H332
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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