AG00378R

40335-00-0 | 2,4-Dimethoxyquinoline

AG00378R

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CAS Number	40335-00-0
Catalog Number	AG00378R(AGN-PC-0JMSMJ)
Chemical Name	2,4-Dimethoxyquinoline
IUPAC Name	2,4-dimethoxyquinoline
InChI	InChI=1S/C11H11NO2/c1-13-10-7-11(14-2)12-9-6-4-3-5-8(9)10/h3-7H,1-2H3
InChI Key	XSZBLRGKCBUWRJ-UHFFFAOYSA-N
MDL Number	MFCD27950422
Molecular Formula	C11H11NO2
Molecular Weight	189.2105
NSC Number	298324
SMILES	COC1=NC2=CC=CC=C2C(=C1)OC
Synonyms	2,4-Dimethoxyquinoline, 40335-00-0, quinoline, 2,4-dimethoxy-, NSC298324, AC1L3L4C, SCHEMBL396614, Yu Borylation Ligand, >=95%, CTK4I2891, DTXSID70193337, XSZBLRGKCBUWRJ-UHFFFAOYSA-N, MFCD27950422, ZINC13282266, AKOS026674211, NSC-298324, AK199077, CS-0012593, InChI=1/C11H11NO2/c1-13-10-7-11(14-2)12-9-6-4-3-5-8(9)10/h3-7H,1-2H, O(C)c1cc(OC)nc2ccccc12, CID142436,

Complexity	186
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	189.079g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	189.214g/mol
Monoisotopic Mass	189.079g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	31.4A^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-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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