AG0030FM

30530-44-0 | 2,4-Diamino-6-(4-fluorophenyl)-1,3,5-triazine

AG0030FM

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CAS Number	30530-44-0
Catalog Number	AG0030FM(AGN-PC-00858K)
Chemical Name	2,4-Diamino-6-(4-fluorophenyl)-1,3,5-triazine
IUPAC Name	6-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine
InChI	InChI=1S/C9H8FN5/c10-6-3-1-5(2-4-6)7-13-8(11)15-9(12)14-7/h1-4H,(H4,11,12,13,14,15)
InChI Key	UPQUQQDAZPFXCH-UHFFFAOYSA-N
MDL Number	MFCD00737286
Molecular Formula	C9H8FN5
Molecular Weight	205.1917
SMILES	FC1=CC=C(C2=NC(N)=NC(N)=N2)C=C1
Synonyms	30530-44-0, 2,4-Diamino-6-(4-fluorophenyl)-1,3,5-triazine, 6-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine, 4'-fluorobenzoguanamine, CHEMBL139399, SCHEMBL2493658, CTK4G5360, DTXSID60464366, ZX-AP005260, 4917AH, MFCD00737286, PC9639, SBB093466, ZINC12959222, AKOS015894736, ACM30530440, 6-(4-Fluorophenyl)-s-triazine-2,4-diamine, FT-0692830, A18612, K-7309, 6-(4-fluorophenyl)-2,4-diamino-1,3,5-triazine, I05-3286, J-017999, 1,3,5-Triazine-2,4-diamine, 6-(4-fluorophenyl)-, 2,4-Diamino-6-(4-fluorophenyl)-1,3,5-triazine, 95%, C9H8FN5, CID11390103,

Complexity	197
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.076g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	205.196g/mol
Monoisotopic Mass	205.076g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	90.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

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

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