AG00EIFW

62235-59-0 | 3-AMinochinolin-2-carbonsaeureethylester

AG00EIFW

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CAS Number	62235-59-0
Catalog Number	AG00EIFW(AGN-PC-0J0YD5)
Chemical Name	3-AMinochinolin-2-carbonsaeureethylester
IUPAC Name	ethyl 3-aminoquinoline-2-carboxylate
InChI	InChI=1S/C12H12N2O2/c1-2-16-12(15)11-9(13)7-8-5-3-4-6-10(8)14-11/h3-7H,2,13H2,1H3
InChI Key	DXRZFETVSRVQEV-UHFFFAOYSA-N
MDL Number	MFCD21603849
Molecular Formula	C12H12N2O2
Molecular Weight	216.2359
SMILES	O=C(C1=NC2=CC=CC=C2C=C1N)OCC
Synonyms	ethyl 3-aminoquinoline-2-carboxylate, 62235-59-0, 2-Quinolinecarboxylic acid, 3-amino-, ethyl ester, SCHEMBL1506611, CTK2C4303, DXRZFETVSRVQEV-UHFFFAOYSA-N, ethyl 3-amino-2-quinolinecarboxylate, MFCD18427520, AKOS033867989, ZINC116383229, AK-55044, AS-50288, SY036036, MFCD18427520 (95%), 3-Aminoquinoline-2-carboxylic acid ethyl ester, Z2346401255, 3-Aminoquinolin-2-ylethylcarbonate,

Complexity	257
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	216.09g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	216.24g/mol
Monoisotopic Mass	216.09g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	65.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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