AG003QC4

105434-90-0 | Ethyl 3-amino-1H-pyrazole-5-carboxylate

AG003QC4

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CAS Number	105434-90-0
Catalog Number	AG003QC4(AGN-PC-0NW34O)
Chemical Name	Ethyl 3-amino-1H-pyrazole-5-carboxylate
IUPAC Name	ethyl 3-amino-1H-pyrazole-5-carboxylate
InChI	InChI=1S/C6H9N3O2/c1-2-11-6(10)4-3-5(7)9-8-4/h3H,2H2,1H3,(H3,7,8,9)
InChI Key	CPQKGGOPHDHAMN-UHFFFAOYSA-N
MDL Number	MFCD03468385
Molecular Formula	C6H9N3O2
Molecular Weight	155.1546
SMILES	NC1=CC(=NN1)C(=O)OCC
Synonyms	ethyl 5-amino-1H-pyrazole-3-carboxylate, 105434-90-0, ethyl 3-amino-1H-pyrazole-5-carboxylate, ethyl 5-aminopyrazole-3-carboxylate, 1886994-04-2, 1H-Pyrazole-3-carboxylic acid, 5-amino-, ethyl ester, Ethyl 5-amino-3-pyrazolecarboxylate, 1H-pyrazole-5-carboxylic acid, 3-amino-, ethyl ester, Ethyl5-amino-1H-pyrazole-3-carboxylate, Ethyl 5-amino-2H-pyrazole-3-carboxylate, ACMC-1CHDF, 3-carbethoxy-5-aminopyrazole, KSC495M5B, SCHEMBL930612, AC1N8O37, CTK3J5650, CTK6F5979, KS-00000BNE, DTXSID60401913, CPQKGGOPHDHAMN-UHFFFAOYSA-N, Ethyl5-Aminopyrazole-3-carboxylate, ALBB-010021, ANW-50498, CE-288, FD7068, MFCD03468385, SBB025726, STK352654, ZINC12397772, AKOS000309876, AKOS005172455, AB15541, ACN-000569, AN-2429, CS-W018572, FS-2645, MCULE-5467332434, RP21943, RTC-069717, TRA0043126, WT82458, AC-22540, AJ-62089, AK-26947, BR-26947, CJ-14023, SC-43748, SY017433, AB0034585, TC-069717, TL8000206, 4CH-000975, 5-aminopyrazol-3-carboxylic acid ethyl ester, AM20080001, BB 0259418, BB 0261123, FT-0645524, ST24033204, ST45064388, X8761, 5-Amino-3-pyrazolecarboxylic acid ethyl ester, S-4590, MFCD03468385 (97+%), 5-amino-2H-pyrazole-3-carboxylic acid ethyl ester, 5-Amino-1H-pyrazole-3-carboxylic acid ethyl ester, I14-3009, J-001420, J-521094, Q-102067, 1H-Pyrazole-3-carboxylicacid, 5-amino-, ethyl ester, I14-12929, C6H9N3O2, Ethyl 3-amino-4-pyrazolecarboxylate, CID4321844, A1984, T1531,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	155.069g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	155.157g/mol
Monoisotopic Mass	155.069g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	81A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

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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