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Ethyl Imidazo[1,2-a]pyrimidine-2-carboxylate

Ethyl Imidazo[1,2-a]pyrimidine-2-carboxylate - CAS 64951-06-0

Catalog:	BB032595
Product Name:	Ethyl Imidazo[1,2-a]pyrimidine-2-carboxylate
CAS:	64951-06-0
Synonyms:	2-imidazo[1,2-a]pyrimidinecarboxylic acid ethyl ester; ethyl imidazo[1,2-a]pyrimidine-2-carboxylate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	ethyl imidazo[1,2-a]pyrimidine-2-carboxylate
Description:	Ethyl Imidazo[1,2-a]pyrimidine-2-carboxylate (CAS# 64951-06-0) is a useful research chemical.
Molecular Weight:	191.19
Molecular Formula:	C9H9N3O2
Canonical SMILES:	CCOC(=O)C1=CN2C=CC=NC2=N1
InChI:	InChI=1S/C9H9N3O2/c1-2-14-8(13)7-6-12-5-3-4-10-9(12)11-7/h3-6H,2H2,1H3
InChI Key:	SORASSFGEFQWIH-UHFFFAOYSA-N
Density:	1.332 g/cm³
MDL:	MFCD02186164
LogP:	0.90600

Publication Number	Title	Priority Date
WO-2021209265-A1	Tricyclic pesticidal compounds	20200414
CN-112573978-A	High-efficiency halogenation synthesis method of aryl halide	20190930
US-2020040039-A1	Peptide compound and method for producing same, composition for screening use, and method for selecting peptide compound	20170321
US-10301284-B2	Therapeutic inhibitory compounds	20160711
US-2018297984-A1	Therapeutic inhibitory compounds	20160711

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Related Functional Groups

Carbonyl Compounds

[87-88-7]
Chloranilic acid
[1427004-19-0]
DBCO-PEG4-NHS ester
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[2168559-63-3]
2-(6-Methyl-2-pyridyl)acetic Acid Hydrochloride
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	222
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	191.069476538
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	191.069476538
Rotatable Bond Count:	3
Topological Polar Surface Area:	56.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7