AG003PM2

624-49-7 | (E)-Dimethyl fumarate

AG003PM2

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CAS Number	624-49-7
Catalog Number	AG003PM2(AGN-PC-0T4GSO)
Chemical Name	(E)-Dimethyl fumarate
EC Number	210-849-0
IUPAC Name	dimethyl (E)-but-2-enedioate
InChI	InChI=1S/C6H8O4/c1-9-5(7)3-4-6(8)10-2/h3-4H,1-2H3/b4-3+
InChI Key	LDCRTTXIJACKKU-ONEGZZNKSA-N
MDL Number	MFCD00064438
Molecular Formula	C6H8O4
Molecular Weight	144.1253
SMILES	O=C(OC)/C=C/C(OC)=O
UNII	FO2303MNI2
Synonyms	00012, BG, 12 compound, BG, 2-butenedioic acid, (2E)-, dimethyl ester, 201, FAG, BG 00012, BG 12 compound, BG-00012, BG-12 compound, BG00012, BG12 compound, compound, BG 12, compound, BG12, dimethyl fumarate, dimethylfumarate, FAG 201, FAG-201, FAG201, Fumaderm, Fumarate, Dimethyl, Tecfidera, Dimethyl fumarate, 624-49-7, Tecfidera, (E)-Dimethyl fumarate, Fumaderm, Dimethyl (E)-but-2-enedioate, Fumaric acid, dimethyl ester, Boletic acid dimethyl ester, Fumaric acid dimethyl ester, Methyl fumarate, BG-12, Dimethyl trans-ethylenedicarboxylate, Allomaleic acid dimethyl ester, Dimethylfumarate, trans-Butenedioic acid dimethyl ester, BIS-METHYL ESTER, 2-Butenedioic acid (E)-, dimethyl ester, trans-1,2-Ethylenedicarboxylic acid dimethyl ester, UNII-FO2303MNI2, BG00012, BG-00012, dimethyl (2E)-but-2-enedioate, BG 12 compound, EINECS 210-849-0, MFCD00064438, NSC 25942, TL 353, NSC 167432, Dimethylester kyseliny fumarove [Czech], BRN 0774590, (E)-but-2-enedioic acid dimethyl ester, Dimethyl 2-butenedioate, 2-Butenedioic acid (2E)-, dimethyl ester, AI3-07872, FO2303MNI2, CHEBI:76004, Ethylene, 1,2-bis(methoxycarbonyl)-, trans-, LDCRTTXIJACKKU-ONEGZZNKSA-N, 2-BUTENEDIOIC ACID, DIMETHYL ESTER, (E)-, Dimethyl fumarate, 99%, Dimethyl fumarate [USAN], Dimethylester kyseliny fumarove, 23055-10-9, WLN: 1OV1U1VO1 -T, dimethyl (2E)but-2-ene-1,4-dioate, Ethylene,2-bis(methoxycarbonyl)-, trans-, FAG201, FAG 201, BG 12 [Fumarate], BG-12 [Fumarate], 2-Butenedioic acid (2E)-, 1,4-dimethyl ester, Dimethyl (2e)-2-butenedioate, 1,4-dimethyl but-2-enedioate, BG 00012, Panaclar, Dimethyl fumar, But-2-enedioic acid, dimethyl ester, dimethyl-fumarate, HSDB 7725, FAG-201, Tecfidera (TN), 1,2-bis(methoxycarbonyl)-trans-ethylene, Fumaric acid dimethyl, AC1LCUHZ, Dimethyl fumarate, 97%, Fumaric acid-dimethyl ester, SCHEMBL41835, SCHEMBL41836, 4-02-00-02205 (Beilstein Handbook Reference), Dimethyl fumarate (JAN/USAN), GTPL7045, CHEMBL2107333, DTXSID4060787, InChI=1/C6H8O4/c1-9-5(7)3-4-6(8)10-2/h3-4H,1-2H3/b4-3, TIMTEC-BB SBB008222, HMS3264D14, Pharmakon1600-01506154, BCP21649, NSC25942, ZINC3843378, UKRORGSYN-BB BBR-008913, AZL O 211089, AZL-O-211089, NSC-25942, NSC167432, NSC760139, s2586, SBB008222, STK039379, 1,4-dimethyl (2E)-but-2-enedioate, AKOS000121333, ZINC100509880, AS01220, CCG-213618, CS-0909, DB08908, FR-1080, NE10584, NSC-167432, NSC-760139, RP20909, RTR-021472, AZL-0211089, 2-Butenedioic acid, 1,4-dimethyl ester, AJ-45818, AK144836, AN-22022, BC226892, CJ-10800, HY-17363, LS-46997, SC-22552, 2(E)-Butenedioic acid 1,4-dimethyl ester, AB2000680, ST2402525, TR-021472, 2-Butenedioic acid, dimethyl ester, (2E)-, F0069, ST50827963, SW219154-1, D03846, W-5060, AB00172980_03, AB00172980_04, Dimethyl fumarate, Vetec(TM) reagent grade, 97%, SR-01000944222, SR-01000944222-1, BRD-K31111078-001-01-8, I14-16593, F0001-1675, FUMARIC ACID DIMETHYL ESTER (1,1,1,8,8,8-D6), Dimethyl fumarate, certified reference material, TraceCERT(R), Dimethyl maleate, null, fumaric acid, Sipomer DMM, BG12 compound, Fumarate, Dimethyl, BG-12 compound, compound, BG12, 12 compound, BG, compound, BG 12, METHYL MALEATE, Dimethyl cis-butenedioate, Maleic acid, dimethyl ester, D0A7MY, 2-Butenedioic acid, (E)-, Dimethyl fumarate, 99% 25g, C6H8O4, Dimethylester kyseliny maleinove, UNII-K39366X5N0, Dimethyl cis-ethylenedicarboxylate, 2-Butenedioic acid, dimethyl ester, 201, FAG, C6-H8-O4, NSC 5161, EINECS 210-848-5, trans-1,2-Ethylenedicarboxylic acid, CID637568, (E)-2-Butenedioic acid dimethyl ester, CS-O-30572, BRN 0471705, Dimethylester kyseliny maleinove [Czech], 2-Butenedioic acid (Z)-, dimethyl ester, 00012, BG, 2-Butenedioic acid (2Z)-, dimethyl ester, 2-Butenedioic acid, (E)-, dimethyl ester, 2-Butenedioic acid, (Z)-, dimethyl ester, 2-Butenedioic acid, dimethyl ester, (Z)-, AI3-07869, 2-butenedioic acid, (2E)-, dimethyl ester, B1931, Dimethyl fumarate, 98.5% - 100G 100g, EC 210-848-5, 4-02-00-02204 (Beilstein Handbook Reference), C056020, D000069462, 624-48-6, DMF,

Complexity	141
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	144.042g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	144.126g/mol
Monoisotopic Mass	144.042g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H302-H315-H317-H319-H401
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 3077

Certificate of Analysis

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