CAS
928713-40-0 Purity
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928713-40-0 Purity
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Asischem c63585
CAS
928713-65-9
Catalog Number
ACM928713659
Category
Other Products
Molecular Formula
C15H17N3O4
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Specification
Synonyms
ASISCHEM C63585;5-PYRIMIDINEPROPANOIC ACID, B-AMINO-2-(3,4-DIMETHOXYPHENYL)-;B-AMINO-2-(3,4-DIMETHOXYPHENYL)-5-PYRIMIDINEPROPANOIC ACID
What is the molecular formula of ASISCHEM C63585?
The molecular formula of ASISCHEM C63585 is C15H17N3O4.
When was ASISCHEM C63585 created and modified?
ASISCHEM C63585 was created on 2007-11-13 and modified on 2023-12-30.
What is the molecular weight of ASISCHEM C63585?
The molecular weight of ASISCHEM C63585 is 303.31 g/mol.
What is the IUPAC name of ASISCHEM C63585?
The IUPAC name of ASISCHEM C63585 is 3-amino-3-[2-(3,4-dimethoxyphenyl)pyrimidin-5-yl]propanoic acid.
What is the InChI of ASISCHEM C63585?
The InChI of ASISCHEM C63585 is InChI=1S/C15H17N3O4/c1-21-12-4-3-9(5-13(12)22-2)15-17-7-10(8-18-15)11(16)6-14(19)20/h3-5,7-8,11H,6,16H2,1-2H3,(H,19,20).
What is the InChIKey of ASISCHEM C63585?
The InChIKey of ASISCHEM C63585 is QMSAUJRNGUTWKD-UHFFFAOYSA-N.
What is the Canonical SMILES of ASISCHEM C63585?
The Canonical SMILES of ASISCHEM C63585 is COC1=C(C=C(C=C1)C2=NC=C(C=N2)C(CC(=O)O)N)OC.
How many hydrogen bond donor counts does ASISCHEM C63585 have?
ASISCHEM C63585 has 2 hydrogen bond donor counts.
What is the topological polar surface area of ASISCHEM C63585?
The topological polar surface area of ASISCHEM C63585 is 108 Ų.
Is ASISCHEM C63585 canonicalized?
Yes, ASISCHEM C63585 is canonicalized.
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