AG0037JD

3878-55-5 | 4-Methoxy-4-oxobutanoic acid

AG0037JD

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CAS Number	3878-55-5
Catalog Number	AG0037JD(AGN-PC-0WAE6B)
Chemical Name	4-Methoxy-4-oxobutanoic acid
EC Number	223-408-2
IUPAC Name	4-methoxy-4-oxobutanoic acid
InChI	InChI=1S/C5H8O4/c1-9-5(8)3-2-4(6)7/h2-3H2,1H3,(H,6,7)
InChI Key	JDRMYOQETPMYQX-UHFFFAOYSA-N
MDL Number	MFCD00002788
Molecular Formula	C5H8O4
Molecular Weight	132.1146
NSC Number	511
SMILES	COC(CCC(=O)O)=O
UNII	YA2V724S0A
Synonyms	3H-methylsuccinate, DL-methylsuccinate, methyl succinate, monomethyl succinate, monomethyl succinate sodium salt, succinic acid monomethyl ester, 4-Methoxy-4-oxobutanoic acid, 3878-55-5, Monomethyl succinate, Mono-Methyl Succinate, Succinic acid monomethyl ester, Methyl hydrogen succinate, 3-Carbomethoxypropanoic acid, Butanedioic acid, monomethyl ester, Succinic acid, monomethyl ester, UNII-YA2V724S0A, mono-Methyl hydrogen succinate, 3-(methoxycarbonyl)propanoic acid, Butanedioic acid, 1-methyl ester, MFCD00002788, YA2V724S0A, butanedioic acid monomethyl ester, JDRMYOQETPMYQX-UHFFFAOYSA-N, mono-Methyl succinate, 98%, butanedioic acid 1-methyl ester, NSC 511, EINECS 223-408-2, Succinic acid 1-methyl, Substrate analogue, 10, AI3-03389, AC1Q5VRX, AC1L2T5M, (S)-Methylbutanethioic acid, DSSTox_CID_24425, DSSTox_RID_80218, Monomethyl hydrogen succinate, DSSTox_GSID_44425, succinic acid 4-methyl ester, SCHEMBL164072, 3-methoxycarbonylpropionic acid, 4-methoxy-4-oxo-butanoic acid, ARONIS006766, NSC511, DTXSID7044425, 4-Methoxy-4-oxobutanoic acid #, BDBM82193, CHEBI:75146, CTK3J0108, JDRMYOQETPMYQX-UHFFFAOYSA-, KS-00003YZV, NSC-511, 4-(methyloxy)-4-oxobutanoic acid, ZINC152993, AC1Q4421, AC1Q4422, ACN-S001857, ACN-S004259, EBD25820, Tox21_302188, mono-Methyl hydrogen succinate, 95%, SBB061270, STL068961, AKOS000264979, CS-W011096, GS-3418, MCULE-4083173324, MP-0271, RP00962, Succinic acid, monomethyl ester (8CI), NCGC00257549-01, AJ-12868, AK-47290, AN-24905, BP-23493, BR-47290, M928, SY009523, CAS-3878-55-5, AM20100028, BB 0254379, FT-0618900, ST45043530, AZ0001-0177, EN300-24949, MFCD00002788 (98%), I04-0309, J-515649, Z57663583, F1107-0326, InChI=1/C5H8O4/c1-9-5(8)3-2-4(6)7/h2-3H2,1H3,(H,6,7), Methyl succinate, monomethylsuccinate, DL-methylsuccinate, 3H-methylsuccinate, C5H8O4, monomethyl succinate sodium salt, C5-H8-O4, CID77487, AR-1G3095, ACN-001857, mono-Methyl succinate, 97% - 25G 25g, C041105, 77341-67-4, 81809-88-3,

Complexity	118
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	132.042g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	132.115g/mol
Monoisotopic Mass	132.042g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	63.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0

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