AG00FAQE

66612-29-1 | N-(4-Aminobutyl)-N-ethylisoluminol

AG00FAQE

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CAS Number	66612-29-1
Catalog Number	AG00FAQE(AGN-PC-0JNNJO)
Chemical Name	N-(4-Aminobutyl)-N-ethylisoluminol
IUPAC Name	6-[4-aminobutyl(ethyl)amino]-2,3-dihydrophthalazine-1,4-dione
InChI	InChI=1S/C14H20N4O2/c1-2-18(8-4-3-7-15)10-5-6-11-12(9-10)14(20)17-16-13(11)19/h5-6,9H,2-4,7-8,15H2,1H3,(H,16,19)(H,17,20)
InChI Key	LEOJISUPFSWNMA-UHFFFAOYSA-N
MDL Number	MFCD00010559
Molecular Formula	C14H20N4O2
Molecular Weight	276.3342
SMILES	O=c1c2c(c(=O)[nH][nH]1)ccc(c2)N(CCCCN)CC
Synonyms	6-(N-(4-aminobutyl)-N-ethyl)amino-2,3-dihydrophthalazine-1,4-dione, ABEI, aminobutylethylisoluminol, N-(4-Aminobutyl)-N-ethylisoluminol, 66612-29-1, ABEI, 6-[(4-aminobutyl)(ethyl)amino]-2,3-dihydrophthalazine-1,4-dione, 6-((4-Aminobutyl)(ethyl)amino)-2,3-dihydrophthalazine-1,4-dione, 6-(N-(4-Aminobutyl)-N-ethyl)amino-2,3-dihydrophthalazine-1,4-dione, 6-[4-aminobutyl(ethyl)amino]-2,3-dihydrophthalazine-1,4-dione, 1,4-Phthalazinedione, 6-((4-aminobutyl)ethylamino)-2,3-dihydro-, 1,4-Phthalazinedione, 6-[(4-aminobutyl)ethylamino]-2,3-dihydro-, 6-[N-(4-Aminobutyl)-N-ethylamino]-2,3-dihydro-1,4-phthalazinedione, AC1L51PT, SCHEMBL437558, DTXSID60216781, LEOJISUPFSWNMA-UHFFFAOYSA-N, ALBB-010784, KS-000016TD, N-(4-Aminobutyl)-N-ethylisolumiol, ZX-AN009601, CA-566, MFCD00010559, STK722002, ZINC20840621, AKOS005172582, AM83808, MCULE-4590226402, AJ-77990, AK-44055, AN-38435, AX8022096, N-(4-Aminobutyl)-N-ethylisoluminol, 90%, CS-0015212, FT-0629202, FT-0641080, R1219, V1203, N-(4-Aminobutyl)-N-ethylisoluminol, >=90%, 612A291, C-17394, SR-01000108578, SR-01000108578-1, N-(4-Aminobutyl)-N-ethylisoluminol[ChemiluminescenceReagent], 6-[(4-Aminobutyl)(ethyl)amino]-2,3-dihydro-1,4-phthalazinedione, Aminobutylethylisoluminol, C14H20N4O2, CID196441, ABEI N-(4-Aminobutyl)-N-ethylisoluminol, A5304, N-(4-Aminobutyl)-N-ethylisoluminol, 97% - 1G 1g,

Complexity	361
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	276.159g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	276.34g/mol
Monoisotopic Mass	276.159g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	87.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

Lot Number