e1AD – 1-ethyladenine

Name
WID	e1AD
Name	1-ethyladenine
Traditional name	6-amino-1-ethyl-9H-purin-1-ium
IUPAC name	6-amino-1-ethyl-9H-purin-1-ium

Classification
Type	modified_nucleobase_ethylation

Structure
Empirical formula (pH 7.5)	H₁₀C₇N₅
SMILES (pH 7.5)	CC[N+]1=C(N)C2=C(NC=N2)N=C1
Charge (pH 7.5)	1
Is hydrophobic	False
Molecular weight (Da)	164.19
van der Waals volume (pH 7.5; Å³ molecule^‑1)	143.99
pI	6.60
logP	-5.12
logD (pH 7.5)	-5.12

Function
Reaction participant	DNA base ethylation (adenine ==> 1-ethyladenine; ethyl methanesulfonate) [c]: AD + EMS + H ⇒ e1AD + MS DNA base ethylation (adenine ==> 1-ethyladenine; ethyl nitrosourea) [c]: AD + ENU + H ⇒ e1AD + NU DNA base ethylation (adenine ==> 1-ethyladenine; diethyl sulfate) [c]: AD + DES + H ⇒ e1AD + ES

Metadata
Created	2012-10-01 15:06:55
Last updated	2012-10-01 15:12:05