AG00EB21

57401-76-0 | 2-Amino-pyrimidine-5-carboxylic acid ethyl ester

AG00EB21

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CAS Number	57401-76-0
Catalog Number	AG00EB21(AGN-PC-0JPEWC)
Chemical Name	2-Amino-pyrimidine-5-carboxylic acid ethyl ester
IUPAC Name	ethyl 2-aminopyrimidine-5-carboxylate
InChI	InChI=1S/C7H9N3O2/c1-2-12-6(11)5-3-9-7(8)10-4-5/h3-4H,2H2,1H3,(H2,8,9,10)
InChI Key	GCGQBUJYXVSZBS-UHFFFAOYSA-N
MDL Number	MFCD04114100
Molecular Formula	C7H9N3O2
Molecular Weight	167.1653
NSC Number	165511
SMILES	O=C(C1=CN=C(N)N=C1)OCC
Synonyms	ethyl 2-aminopyrimidine-5-carboxylate, 57401-76-0, 2-Amino-pyrimidine-5-carboxylic acid ethyl ester, 2-Aminopyrimidine-5-carboxylic acid ethyl ester, Ethyl 2-amino-5-pyrimidinecarboxylate, 5-Pyrimidinecarboxylic acid, 2-amino-, ethyl ester, 5-Carbethoxy-2-pyrimidinamine, NSC165511, PubChem22201, AC1L6P5M, KSC606Q0L, SCHEMBL5364037, 2-amino-5-carboethoxypyrimidine, CTK5A6805, KS-00000MUE, DTXSID40304357, GCGQBUJYXVSZBS-UHFFFAOYSA-N, ZINC1644962, ANW-49299, MFCD04114100, 2-amino 5-ethoxy-carbonyl-pyrimidine, AKOS006294898, AB17890, CM10697, CS-W003155, DS-1225, LS20015, NSC-165511, AJ-28669, AK-50608, BR-50608, CJ-05900, CJ-26544, SC-94941, SY014488, TS-00140, AB0025591, ST2412918, TC-138044, 2-Amino-pyrimidine-5-carboxylicacidethylester, 4CH-001824, FT-0764770, W7077, MFCD04114100 (95%), A18918, A57405, S-3067, 5-Pyrimidinecarboxylicacid, 2-amino-, ethyl ester, Z1741977280, C7H9N3O2, CID295889, 2,6-DICHLOROPYRIMIDINE-4-CARBONITRILE, 26293-93-6,

Complexity	155
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	167.069g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	167.168g/mol
Monoisotopic Mass	167.069g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	78.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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