AG00FFCZ

69034-08-8 | 2-Pyrimidinamine, 5-(trifluoromethyl)- (9CI)

AG00FFCZ

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CAS Number	69034-08-8
Catalog Number	AG00FFCZ(AGN-PC-00OOQ8)
Chemical Name	2-Pyrimidinamine, 5-(trifluoromethyl)- (9CI)
IUPAC Name	5-(trifluoromethyl)pyrimidin-2-amine
InChI	InChI=1S/C5H4F3N3/c6-5(7,8)3-1-10-4(9)11-2-3/h1-2H,(H2,9,10,11)
InChI Key	OUVVCECMELPNNT-UHFFFAOYSA-N
MDL Number	MFCD10696951
Molecular Formula	C5H4F3N3
Molecular Weight	163.1006
SMILES	NC1=NC=C(C(F)(F)F)C=N1
Synonyms	5-(Trifluoromethyl)pyrimidin-2-amine, 69034-08-8, 2-Amino-5-(trifluoromethyl)pyrimidine, 5-TRIFLUOROMETHYL-PYRIMIDIN-2-YLAMINE, 2-Pyrimidinamine, 5-(trifluoromethyl)- (9CI), 2-amino-5-trifluoromethylpyrimidine, 5-TRIFLUOROMETHYLPYRIMIDIN-2-YLAMINE, 2-PYRIMIDINAMINE, 5-(TRIFLUOROMETHYL)-, SCHEMBL1008590, CTK2F2270, DTXSID70570846, OUVVCECMELPNNT-UHFFFAOYSA-N, KS-00000N8T, 0649AC, MFCD10696951, ZINC34515201, 5-(trifluoromethyl)-2-pyrimidinamine, AKOS006305321, AB58610, FS-3306, AJ-89038, AK116218, AM804232, SC-14822, DB-074096, [5-(trifluoromethyl)-pyrimidin-2-yl]-amine, CS-0030460, FT-0703218, S03-0480, Z1741977695, C5H4F3N3,

Complexity	127
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	163.036g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	163.103g/mol
Monoisotopic Mass	163.036g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	51.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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