AG00C3VB

2378-95-2 | diethyl N-[4-(methylamino)benzoyl]-L-glutamate

AG00C3VB

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CAS Number	2378-95-2
Catalog Number	AG00C3VB(AGN-PC-0O84GU)
Chemical Name	diethyl N-[4-(methylamino)benzoyl]-L-glutamate
EC Number	219-161-5
IUPAC Name	diethyl (2S)-2-[[4-(methylamino)benzoyl]amino]pentanedioate
InChI	InChI=1S/C17H24N2O5/c1-4-23-15(20)11-10-14(17(22)24-5-2)19-16(21)12-6-8-13(18-3)9-7-12/h6-9,14,18H,4-5,10-11H2,1-3H3,(H,19,21)/t14-/m0/s1
InChI Key	WBYNXAAEBPJETG-AWEZNQCLSA-N
MDL Number	MFCD00136328
Molecular Formula	C17H24N2O5
Molecular Weight	336.3829
SMILES	O=C(OCC)[C@@H](NC(C1=CC=C(NC)C=C1)=O)CCC(OCC)=O
Synonyms	2378-95-2, (S)-Diethyl 2-(4-(methylamino)benzamido)pentanedioate, Diethyl N-[4-(methylamino)benzoyl]-L-glutamate, Diethyl N-(4-(methylamino)benzoyl)-L-glutamate, diethyl (2S)-2-[[4-(methylamino)benzoyl]amino]pentanedioate, N-(p-Methylaminobenzoyl)glutamic acid diethyl ester, Diethyl N-(p-N-methylaminobenzoyl)glutamate, P-N-Methylaminobenzoyl Glutamic Acid Diethyl Ester, L-Glutamic acid, N-(4-(methylamino)benzoyl)-, diethyl ester, L-Glutamic acid, N-(4-(methylamino)benzoyl)-, 1,5-diethyl ester, EINECS 219-161-5, NSC 121189, PubChem20742, AC1L2OPL, DIETHYL N-(4-METHYLAMINOBENZOYL)-L-GLUTAMATE, EC 219-161-5, AC1Q63IM, SCHEMBL6648903, WBYNXAAEBPJETG-AWEZNQCLSA-N, EBD90334, Glutamic acid, N-(p-(methylamino)benzoyl)-, diethyl ester, L-, ZINC1557549, 1653AB, diethyl p-(methyl)aminobenzoylglutamate, ACM2378952, AJ-27003, AX8124730, diethyl N-(p-methylaminobenzoyl)-L-glutamate, FT-0698068, diethyl N-[4-(N-methylamino)-benzoyl]glutamate, N-(4-N-Methylaminobenzoyl)-L-glutamic acid diethyl ester, N-[4-(Methylamino)benzoyl]-L-glutamic acid diethyl ester, C17H24N2O5, CID75413, diethylN-[4- benzoyl]-L-glutamate, AR-1I4749, C17-H24-N2-O5, (S)-Diethyl2-(4-(methylamino)benzamido)pentanedioate, L-Glutamic acid, N-[4-(methylamino)benzoyl]-, diethyl ester, 24319-16-2,

Complexity	419
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	336.169g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	336.388g/mol
Monoisotopic Mass	336.169g/mol
Rotatable Bond Count	11
Topological Polar Surface Area	93.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H341-H361
Packing Group	Ⅲ
Precautionary statements	P201-P202-P281-P308+P313-P405-P501
UN Code	UN 2811

Certificate of Analysis

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