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N2-(4-Aminophenyl)-N4,N4,6-trimethyl-2,4-pyrimidinediamine

N2-(4-Aminophenyl)-N4,N4,6-trimethyl-2,4-pyrimidinediamine - CAS 1395786-40-9

Catalog:	BB055004
Product Name:	N2-(4-Aminophenyl)-N4,N4,6-trimethyl-2,4-pyrimidinediamine
CAS:	1395786-40-9
Synonyms:	N2-(4-aminophenyl)-N4,N4,6-trimethylpyrimidine-2,4-diamine; 2-N-(4-aminophenyl)-4-N,4-N,6-trimethylpyrimidine-2,4-diamine; N~2~-(4-aminophenyl)-N~4~,N~4~,6-trimethylpyrimidine-2,4-diamine; N2-(4-Aminophenyl)-N4,N4,6-trimethyl-2,4-pyrimidinediamine

Technical Data

Computed Properties

IUPAC Name:	2-N-(4-aminophenyl)-4-N,4-N,6-trimethylpyrimidine-2,4-diamine
Molecular Weight:	243.31
Molecular Formula:	C13H17N5
Canonical SMILES:	CC1=CC(=NC(=N1)NC2=CC=C(C=C2)N)N(C)C
InChI:	InChI=1S/C13H17N5/c1-9-8-12(18(2)3)17-13(15-9)16-11-6-4-10(14)5-7-11/h4-8H,14H2,1-3H3,(H,15,16,17)
InChI Key:	LYQRHCXHOCPMFZ-UHFFFAOYSA-N

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Complexity:	250
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	243.14839556
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	243.14839556
Rotatable Bond Count:	3
Topological Polar Surface Area:	67.1Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3