AG003PLE

3304-70-9 | Dimethyl 4,5-imidazoledicarboxylate

AG003PLE

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CAS Number	3304-70-9
Catalog Number	AG003PLE(AGN-PC-0JLQA3)
Chemical Name	Dimethyl 4,5-imidazoledicarboxylate
IUPAC Name	dimethyl 1H-imidazole-4,5-dicarboxylate
InChI	InChI=1S/C7H8N2O4/c1-12-6(10)4-5(7(11)13-2)9-3-8-4/h3H,1-2H3,(H,8,9)
InChI Key	CUIWFAXEALIQJS-UHFFFAOYSA-N
MDL Number	MFCD00051338
Molecular Formula	C7H8N2O4
Molecular Weight	184.1494
SMILES	C(=O)(OC)c1c(C(=O)OC)[nH]cn1
Synonyms	3304-70-9, DIMETHYL 4,5-IMIDAZOLEDICARBOXYLATE, Dimethyl 1H-imidazole-4,5-dicarboxylate, 1H-Imidazole-4,5-dicarboxylic acid dimethyl ester, Dimethyl imidazole-4,5-dicarboxylate, 1H-Imidazole-4,5-dicarboxylic acid, dimethyl ester, 4,5-dimethyl 1H-imidazole-4,5-dicarboxylate, CUIWFAXEALIQJS-UHFFFAOYSA-N, Imidazole-4,5-dicarboxylic acid, dimethyl ester, Dimethyl 4,5-imidazole-dicarboxylate, 1H-Imidazole-4,5-dicarboxylic acid, 4,5-dimethyl ester, AK-49148, Imidazole-4, dimethyl ester, 1H-Imidazole-4, dimethyl ester, MFCD00051338, NSC 44628, NSC 44693, PubChem9391, dimethyl1H-imidazole-4,5-dicarboxylate, AC1Q5ZEQ, ACMC-209hy4, 4,5-Imidazoledicarboxylic acid, dimethyl ester, AC1L2RQ0, AC1Q42JM, TimTec1_005020, KSC496I2H, MLS000767417, SCHEMBL1081091, 4,5-dimethoxycarbonyl-imidazole, CHEMBL2134742, DTXSID1062966, CTK3J6423, KS-00000BPQ, ZINC39577, Dimethyl4,5-imidazoledicarboxylate, HMS1548E04, HMS2779F19, ACT02005, ALBB-016090, BB_SC-02543, DimethylImidazole-4,5-dicarboxylate, EBD27130, NSC44628, NSC44693, ZERO/008399, ZX-AN014795, ANW-27530, BBL010648, CD-607, dimethyl 4,5 imidazole dicarboxylate, dimethyl 4,5-imidazole dicarboxylate, HTS001655, NSC-44628, NSC-44693, SBB014177, STK723348, AKOS004117730, ACM3304709, CS-W002240, MCULE-8064341814, RP24450, RTC-064327, TRA0082109, VI10196, NCGC00246369-01, AJ-08869, AS-11909, BC226257, BP-21477, BR-49148, CC-26910, CJ-00253, OR323255, SC-03531, SMR000429771, SY021992, ZB001158, Dimethyl 4,5-imidazoledicarboxylate, 97%, AX8010569, DB-048326, Dimethyl 1H-imidazole-4,5-dicarboxylate #, ST2412829, TC-064327, 4CH-006721, A5904, AM20090499, C3323, FT-0625064, I0456, ST50307400, MFCD00051338 (97%), S-1395, 304D709, C-07204, methyl 4-(methoxycarbonyl)imidazole-5-carboxylate, methyl 5-(methoxycarbonyl)imidazole-4-carboxylate, SR-01000388931, I14-2475, J-520362, SR-01000388931-1, 1H-Imidazole-4,5-dicarboxylic acid dimethyl ester, 98%, F0391-0004, C7H8N2O4, C7-H8-N2-O4, CID76810, AR-1I5403, ACN-000692, 1H-Imidazole-4,5-dicarboxylic acid dimethyl ester, 98% - 25G 25g, 33991-29-6,

Complexity	219
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	184.048g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	184.151g/mol
Monoisotopic Mass	184.048g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	81.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number