AG00EJUT

64922-04-9 | 1H-[1,2,4]Triazole-3-carboxylic acid, ethyl ester

AG00EJUT

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	64922-04-9
Catalog Number	AG00EJUT(AGN-PC-0OEZG5)
Chemical Name	1H-[1,2,4]Triazole-3-carboxylic acid, ethyl ester
IUPAC Name	ethyl 1H-1,2,4-triazole-5-carboxylate
InChI	InChI=1S/C5H7N3O2/c1-2-10-5(9)4-6-3-7-8-4/h3H,2H2,1H3,(H,6,7,8)
InChI Key	DHZYWCBUDKTLGD-UHFFFAOYSA-N
MDL Number	MFCD00619109
Molecular Formula	C5H7N3O2
Molecular Weight	141.1280
NSC Number	80859
SMILES	O=C(C1=NNC=N1)OCC
Synonyms	64922-04-9, ethyl 1H-1,2,4-triazole-5-carboxylate, Ethyl 1H-1,2,4-triazole-3-carboxylate, ethyl 4H-1,2,4-triazole-3-carboxylate, DHZYWCBUDKTLGD-UHFFFAOYSA-N, 1H-1,2,4-triazole-3-carboxylic acid ethyl ester, 1H-1,2,4-Triazole-5-carboxylic acid Ethyl ester, 1H-1,2,4-Triazole-5-carboxylicacid, ethyl ester, 1H-[1,2,4]Triazole-3-carboxylic acid, ethyl ester, NSC80859, AC1L5SBE, SCHEMBL754148, AC1Q64N9, SCHEMBL9920430, CTK5C1863, KS-00003HLJ, DTXSID30292219, ethyl1,2,4-triazole-3-carboxylate, ZINC5575597, ZX-CM010867, BBL006989, CCG-40393, HTS004661, MFCD19705874, NSC-80859, STL133419, AKOS005744462, AKOS011534096, BS-3800, MCULE-4242520860, Ethyl-1H-1,2,4-triazole-5-carboxylate, AB0107486, DB-073552, Ethyl 1H-1,2,4-triazole-3-carboxylate #, FT-0686743, 1H-[1,2,4]triazole-3-carboxylate ethyl ester, A-6987, A19021, 1H-1,2,4-triazol-3-carboxylic acid ethyl ester, 1H-[1,2,4]triazole-3-carboxylic acid ethyl ester, 1H-1,2,4-Triazole-3-carboxylic acid, ethyl ester, 4H-[1,2,4]triazole-3-carboxylic acid ethyl ester, I04-8308, Z1483470218, 5-Aminophthalide, C5H7N3O2, 5-aminoisobenzofuran-1(3H)-one, AR-1I7938, CID255397, 1H-[1,2,4]Triazole-3-carboxylicacid,ethylester, 1H-1,2,4-Triazole-3-carboxylic acid, ethyl ester (9CI), 65399-05-5,

Complexity	128
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	141.054g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	141.13g/mol
Monoisotopic Mass	141.054g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	67.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

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

Lot Number