2-(2,6-diaminohexanamido)-4-methylpentanoic acid

2-(2,6-diaminohexanamido)-4-methylpentanoic acid

Formula: C12H25N3O3

SMILES: CC(C)CC(NC(=O)C(N)CCCCN)C(O)=O

IUPAC: 2-(2,6-diaminohexanamido)-4-methylpentanoic acid

InChI: InChI=1/C12H25N3O3/c1-8(2)7-10(12(17)18)15-11(16)9(14)5-3-4-6-13/h8-10H,3-7,13-14H2,1-2H3,(H,15,16)(H,17,18)

Composition: C (55.57%), H (9.72%), N (16.20%), O (18.51%)

Molar Mass: 259.35

Atom Count: 43

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	259.189591677
Formal Charge	0
FSP3	0.83
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	4
InChIKey	ATIPDCIQTUXABX-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.78
Topological Polar Surface Area	118.44
Polarizability	27.63
Ring Count	0
Rotatable Bond Count	9

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C12H25N3O3		Quote Only