AG00I9WM

55496-52-1 | Quinazoline, 4-chloro-7-methoxy-

AG00I9WM

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CAS Number	55496-52-1
Catalog Number	AG00I9WM(AGN-PC-022OWS)
Chemical Name	Quinazoline, 4-chloro-7-methoxy-
IUPAC Name	4-chloro-7-methoxyquinazoline
InChI	InChI=1S/C9H7ClN2O/c1-13-6-2-3-7-8(4-6)11-5-12-9(7)10/h2-5H,1H3
InChI Key	GUQZHZBMDPEBQG-UHFFFAOYSA-N
MDL Number	MFCD06738758
Molecular Formula	C9H7ClN2O
Molecular Weight	194.6177
SMILES	COC1=CC2=NC=NC(Cl)=C2C=C1
Synonyms	4-Chloro-7-methoxyquinazoline, 55496-52-1, 4-Chloro-7-methoxy-quinazoline, QUINAZOLINE, 4-CHLORO-7-METHOXY-, PubChem19156, SCHEMBL144584, 4-chloro-7- methoxyquinazoline, CTK5A3714, DTXSID80596532, Quinazoline,4-chloro-7-methoxy-, GUQZHZBMDPEBQG-UHFFFAOYSA-N, CS-D0278, KS-00000P5G, ANW-47869, CC-043, CC0232, MFCD06738758, ZINC11757222, AKOS006229493, AB27825, VZ28806, AJ-60079, AK-29394, BR-29394, DS-11103, HC210347, SC-55369, AB0025478, ST2411344, TL8003620, TR-019563, FT-0649222, W6949, S-5835, 554C965, I14-9269, C9H7ClN2O, ACN-038882,

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
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number