AG00IA6K

57078-98-5 | 1H-Pyrrole-1-butanoic acid, 2,5-dihydro-2,5-dioxo-

AG00IA6K

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CAS Number	57078-98-5
Catalog Number	AG00IA6K(AGN-PC-0KTTWB)
Chemical Name	1H-Pyrrole-1-butanoic acid, 2,5-dihydro-2,5-dioxo-
IUPAC Name	4-(2,5-dioxopyrrol-1-yl)butanoic acid
InChI	InChI=1S/C8H9NO4/c10-6-3-4-7(11)9(6)5-1-2-8(12)13/h3-4H,1-2,5H2,(H,12,13)
InChI Key	NCPQROHLJFARLL-UHFFFAOYSA-N
MDL Number	MFCD00043139
Molecular Formula	C8H9NO4
Molecular Weight	183.1614
SMILES	O=C(CCCN1C(=O)C=CC1=O)O
Synonyms	4-Maleimidobutyric acid, 57078-98-5, 4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)butanoic acid, N-Maleoyl-GABA, Maleimide-(CH2)3-COOH, 1H-Pyrrole-1-butanoic acid, 2,5-dihydro-2,5-dioxo-, 4-(2,5-dioxo-2H-pyrrol-1(5H)-yl)butanoic acid, 4-MaleimidobutyricAcid(GMBA), 4-Maleimiobutyric Acid, 4-(2,5-dioxopyrrol-1-yl)butanoic Acid, AC1MP3BA, gamma-Maleimidobutyric acid, N-(3-Carboxypropyl)maleimide, SCHEMBL155346, N-Maleoyl-4-aminobutyric acid, CTK1G9289, DTXSID90392183, NCPQROHLJFARLL-UHFFFAOYSA-N, BB_SC-07650, KS-00000ML2, ZINC2168682, 4-(2,5-dioxoazolinyl)butanoic acid, BBL027988, FD6069, KM0068, MFCD00043139, STK929546, AKOS000150996, BBV-036034, GS-6122, MCULE-4350357503, VZ29290, 2,5-Dioxo-3-pyrroline-1-butyric acid, (2R,6R)-2,6-Dimethylpiperazine-2HCl, AC-30052, AJ-33902, AK115628, BP-21999, OR323076, SC-50050, SY057251, 4-Maleimidobutyric acid, >=98.0% (T), AB0049105, AX8006563, DB-003495, AK00743261, BB 0218442, FT-0604088, M2337, ST51016095, 4-Maleimidobutyric acid, >=98% (titration), MFCD00043139 (98%), 1H-Pyrrole-1-butanoicacid, 2,5-dihydro-2,5-dioxo-, I14-50702, 4-(2,5-Dioxo-2,5-dihydro-pyrrol-1-yl)-butanoic acid, CID3404904, 4-Maleimidobutyric acid, 98% - 1G 1g, A8148, 4-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)butanoicacid, 107914-00-1, MBA,

Complexity	264
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	183.053g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	183.163g/mol
Monoisotopic Mass	183.053g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	74.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number