CAS:17325-26-7 / methyl 1H-imidazole-5-carboxylate--Hangzhou Chempro Technology Co., Ltd.

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CAS Number: 17325-26-7
methyl 1H-imidazole-5-carboxylate

Structure
Name: methyl 1H-imidazole-5-carboxylate
Synonyms:

General Information

Product Number: 17325267

CAS Registry Number: 17325-26-7

Name:

1H-Imidazole-5-carboxylic acid, methyl ester

1H-Imidazole-4-carboxylic acid, methyl ester (9CI); Imidazole-4(or 5)-carboxylic acid, methyl ester (7CI); Imidazole-4-carboxylic acid, methyl ester (8CI); 3H-Imidazole-4-carboxylic acid methyl ester; 4(5)-Imidazolecarboxylic acid methyl ester; 4-(Methoxycarbonyl)imidazole; Methyl 1H-imidazole-4-carboxylate; Methyl imidazole-4(or 5)-carboxylate; Methyl imidazole-4-carboxylate; Methyl imidazole-5-carboxylate

Chemical Formula: C5H6N2O2

Exact Mass: 126.04

Molecular Weight: 126.11

m/z: 126.04 (100.0%), 127.05 (5.6%)

Elemental Analysis: C, 47.62; H, 4.80; N, 22.21; O, 25.37

InChI: InChI=1S/C5H6N2O2/c1-9-5(8)4-2-6-3-7-4/h2-3H,1H3,(H,6,7)

InChIKey: DVLGIQNHKLWSRU-UHFFFAOYSA-N

Canonical SMILES : COC(=O)C1=CN=CN1

Thermal Properties	Value	Condition	Note
Melting Point	154-155 °C	Solv: acetone (67-64-1)	(5)IC
Melting Point	153-154 °C	Solv: ethyl acetate (141-78-6)	(3)IC

Specification

98%

References

(1) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
(2) Weitman, Michal; Tetrahedron 2010, V66(7), P1465-1471 CAPLUS
(3) Kress, Thomas J.; Journal of Organic Chemistry 1985, V50(17), P3073-6 CAPLUS
(4) Maquestiau, A.; Journal of Organic Chemistry 1986, V51(3), P306-9 CAPLUS
(5) Takahashi, Kazuyuki; Nippon Kagaku Kaishi 1975, (12), P2244-5 CAPLUS
(6) Alkorta, Ibon; Structural Chemistry 2005, V16(5), P507-514 CAPLUS

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