AG00BBXV

23785-21-9 | Ethyl imidazole-4-carboxylate

AG00BBXV

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CAS Number	23785-21-9
Catalog Number	AG00BBXV(AGN-PC-0O84LH)
Chemical Name	Ethyl imidazole-4-carboxylate
IUPAC Name	ethyl 1H-imidazole-5-carboxylate
InChI	InChI=1S/C6H8N2O2/c1-2-10-6(9)5-3-7-4-8-5/h3-4H,2H2,1H3,(H,7,8)
InChI Key	KLWYPRNPRNPORS-UHFFFAOYSA-N
MDL Number	MFCD02646639
Molecular Formula	C6H8N2O2
Molecular Weight	140.1399
NSC Number	191283
SMILES	C1=C([NH]C=N1)C(OCC)=O
UNII	NIC7LR0ZON
Synonyms	C 751, C-751, ethyl 4(5)-imidazolecarboxylate, Ethyl 1H-imidazole-4-carboxylate, 23785-21-9, Ethyl imidazole-4-carboxylate, Ethyl 1H-imidazole-5-carboxylate, Ethyl 4-imidazolecarboxylate, Ethyl 4(5)-imidazolecarboxylate, NIC7LR0ZON, UNII-NIC7LR0ZON, MFCD02646639, 4-CARBETHOXYIMIDAZOLE, 1H-Imidazole-4-carboxylic acid ethyl ester, 1H-Imidazole-4-carboxylic acid, ethyl ester, C-751, KLWYPRNPRNPORS-UHFFFAOYSA-N, Imidazole-4-carboxylic acid ethyl ester, zlchem 862, NSC 191283, PubChem19079, ACMC-1CCNL, AC1L40PH, AC1Q64LO, Ethyl-4-imidazolecarboxylate, KSC493K7B, SCHEMBL179565, CTK3J3570, CTK8E2367, DTXSID60178471, ZLD0323, 4-(ETHOXYCARBONYL)IMIDAZOLE, ACT09368, BCP13439, Ethyl 1H-imidazole-5-carboxylate #, AN-655, ANW-25217, CE-399, CE0084, MFCD07363812, NSC191283, SBB067432, WT1311, ZINC13281753, AKOS006335111, AKOS013153465, 4-Imidazolecarboxylic Acid Ethyl Ester, AB11920, AC-6894, CM14066, CS-W002941, NSC-191283, PS-5461, QC-9083, RP01244, RTC-067582, KS-000005K4, ETHYL 3H-IMIDAZOLE-4-CARBOXYLATE, Imidazole-5-carboxylic acid, ethyl ester, AJ-63547, AK-25642, BR-25642, CJ-14333, SC-21238, SY009035, AB0043986, DB-002092, ST2419286, TC-067582, 1H-Imidazole-5-carboxylic acid, ethyl ester, 23785-21-9 Ethyl imidazole-4-carboxylate, 4CH-013387, E1042, FT-0084499, FT-0602286, MFCD02646639 (98%), E67419, M-3323, X-1423, 785E219, I14-3320, Q-103102, C6H8N2O2, ETHYLIMIDAZOLE-4-CARBOXYLATE, C6-H8-N2-O2, CID99170, AR-1I7939, ACN-025559, 1H-Imidazole-5-carboxylicacid,ethylester, C 751, C2769, Ethyl 1H-imidazole-5-carboxylate, 98% - 1G 1g, 24311-78-2,

Complexity	127
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	140.059g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	140.142g/mol
Monoisotopic Mass	140.059g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

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

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