CAS
928713-96-6 Purity
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928713-96-6 Purity
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Asischem c63617
CAS
928714-06-1
Catalog Number
ACM928714061
Category
Other Products
Molecular Formula
C13H12FN3O2
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Specification
Synonyms
ASISCHEM C63617;5-PYRIMIDINEPROPANOIC ACID, B-AMINO-2-(2-FLUOROPHENYL)-;B-AMINO-2-(2-FLUOROPHENYL)-5-PYRIMIDINEPROPANOIC ACID
What is the molecular formula of Asischem c63617?
The molecular formula of Asischem c63617 is C13H12FN3O2.
What is the molecular weight of Asischem c63617?
The molecular weight of Asischem c63617 is 261.25 g/mol.
When was Asischem c63617 created and modified?
Asischem c63617 was created on 2007-11-13 and modified on 2023-12-30.
What is the IUPAC name of Asischem c63617?
The IUPAC name of Asischem c63617 is 3-amino-3-[2-(2-fluorophenyl)pyrimidin-5-yl]propanoic acid.
What is the InChI of Asischem c63617?
The InChI of Asischem c63617 is InChI=1S/C13H12FN3O2/c14-10-4-2-1-3-9(10)13-16-6-8(7-17-13)11(15)5-12(18)19/h1-4,6-7,11H,5,15H2,(H,18,19).
What is the InChIKey of Asischem c63617?
The InChIKey of Asischem c63617 is NFQJUSFMOQIRSI-UHFFFAOYSA-N.
What is the Canonical SMILES of Asischem c63617?
The Canonical SMILES of Asischem c63617 is C1=CC=C(C(=C1)C2=NC=C(C=N2)C(CC(=O)O)N)F.
What is the hydrogen bond donor count of Asischem c63617?
The hydrogen bond donor count of Asischem c63617 is 2.
What is the hydrogen bond acceptor count of Asischem c63617?
The hydrogen bond acceptor count of Asischem c63617 is 6.
Is the compound canonicalized for Asischem c63617?
Yes, the compound is canonicalized for Asischem c63617.
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