AG005KDX

793-19-1 | phenanthro(1,2-b)furan-10,11-dione, 6,7,8,9-tetrahydro-7-hydroxy-1-methyl-6-methylene-

AG005KDX

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CAS Number	793-19-1
Catalog Number	AG005KDX(AGN-PC-0UEBP6)
Chemical Name	phenanthro(1,2-b)furan-10,11-dione, 6,7,8,9-tetrahydro-7-hydroxy-1-methyl-6-methylene-
EC Number	212-343-5
IUPAC Name	methyl 3-[benzyl-(3-methoxy-3-oxopropyl)amino]propanoate
InChI	InChI=1S/C15H21NO4/c1-19-14(17)8-10-16(11-9-15(18)20-2)12-13-6-4-3-5-7-13/h3-7H,8-12H2,1-2H3
InChI Key	KPRYGTMLHJYBFC-UHFFFAOYSA-N
MDL Number	MFCD00025891
Molecular Formula	C15H21NO4
Molecular Weight	279.3315
NSC Number	54971
SMILES	O=C(OC)CCN(CCC(OC)=O)CC1=CC=CC=C1
Synonyms	793-19-1, dimethyl 3,3'-(benzylazanediyl)dipropanoate, 3-[Benzyl-(2-Methoxycarbonyl-Ethyl)-Amino]-Propionic Acid Methyl Ester, Methyl N-benzyl-N-(3-methoxy-3-oxopropyl)-beta-alaninate, dimethyl 3,3' - (benzylazanediyl)dipropanoate, methyl 3-[benzyl-(3-methoxy-3-oxopropyl)amino]propanoate, dimethyl 3,3'-(benzylimino)dipropanoate (non-preferred name), NSC54971, EINECS 212-343-5, AC1L2CZ8, DIMETHYL 3,3'-(BENZYLIMINO)DIPROPIONATE, AC1Q443U, AC1Q443V, AC1Q600H, SCHEMBL3258895, DTXSID30229606, KPRYGTMLHJYBFC-UHFFFAOYSA-N, dimethyl 3,3'-(benzylimino)dipropanoate(non-preferred name), KS-00000K7D, ZINC1685520, 2113AJ, AB1155, BBL018503, MFCD00025891, NSC-54971, STL193537, AKOS022060834, DS-7996, MCULE-9734184538, AJ-29826, AK154671, SC-90573, AB0085572, DB-056358, dimethyl 3,3'-(benzylazanediyl)dipropionate, FT-0083214, FT-0632964, N,N-Di[2-(methoxycarbonyl)ethyl]benzylamine, N,N-bis(beta-methoxy carbonylethyl)benzylamine, 3,3'-(Benzylimino)dipropionic acid dimethyl ester, 3,3'-Benzyliminobis(propanoic acid methyl) ester, methyl 3-[(3-methoxy-3-oxopropyl)-(phenylmethyl)amino]propanoate, 3-Benzyl-(2-methoxycarbonyl-ethyl)- amino-propionic acid methyl ester, C15H21NO4, CID69926, AR-1I5510, C15-H21-N-O4, H1378, 3-[BENZYL- -AMINO]-PROPIONICACIDMETHYLESTER, 837-08-1,

Complexity	280
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	279.147g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	279.336g/mol
Monoisotopic Mass	279.147g/mol
Rotatable Bond Count	10
Topological Polar Surface Area	55.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

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