CAS
90322-88-6 Purity
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90322-88-6 Purity
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7-Amino-2-hydroxy-1,8-naphthyridine-4-carboxylic acid
CAS
90323-16-3
Catalog Number
ACM90323163
Category
Other Products
Molecular Weight
205.17
Molecular Formula
C9H7N3O3
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Specification
Synonyms
IFLAB-BB F2113-0030;7-AMINO-2-HYDROXY-1,8-NAPHTHYRIDINE-4-CARBOXYLIC ACID
IUPAC Name
7-amino-2-oxo-1H-1,8-naphthyridine-4-carboxylic acid
Canonical SMILES
C1=CC(=NC2=C1C(=CC(=O)N2)C(=O)O)N
InChI Key
BXHBQLMTFKNEOC-UHFFFAOYSA-N
Boiling Point
505.8ºC at 760mmHg
Flash Point
259.7ºC
Density
1.604g/cm³
Exact Mass
205.04900
H-Bond Acceptor
5
H-Bond Donor
3
What is the molecular formula of the compound?
The molecular formula of the compound is C9H7N3O3.
What is the molecular weight of the compound?
The molecular weight of the compound is 205.17 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is 7-amino-2-oxo-1H-1,8-naphthyridine-4-carboxylic acid.
What is the CAS number of the compound?
The CAS number of the compound is 90323-16-3.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C9H7N3O3/c10-6-2-1-4-5(9(14)15)3-7(13)12-8(4)11-6/h1-3H,(H,14,15)(H3,10,11,12,13).
What is the InChIKey of the compound?
The InChIKey of the compound is BXHBQLMTFKNEOC-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES of the compound is C1=CC(=NC2=C1C(=CC(=O)N2)C(=O)O)N.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value of the compound is -0.5.
How many hydrogen bond donor counts does the compound have?
The compound has 3 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does the compound have?
The compound has 5 hydrogen bond acceptor counts.
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