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Structure

4-[2-(2-Amino-4-oxo-1H-pteridin-6-yl)ethylamino]benzoic acid

CAS
4833-56-1
Catalog Number
ACM4833561
Category
Other Products
Molecular Weight
326.31 g/mol
Molecular Formula
C15H14N6O3

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Specification

Synonyms
Homopteroic acid; Homopteroesaeure;
IUPAC Name
4-[2-(2-amino-4-oxo-1H-pteridin-6-yl)ethylamino]benzoic acid
Canonical SMILES
C1=CC(=CC=C1C(=O)O)NCCC2=CN=C3C(=N2)C(=O)N=C(N3)N
InChI Key
DTDQDDMTACYSOK-UHFFFAOYSA-N
Boiling Point
695.9ºC at 760 mmHg
Flash Point
374.7ºC
Density
1.62g/cm³
Exact Mass
326.11300
H-Bond Acceptor
8
H-Bond Donor
4
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