CAS
985-84-2 Purity
96%
985-84-2 Purity
96%
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4-Pyridinebutanoicacid, a,g-dioxo-
CAS
98589-58-3
Catalog Number
ACM98589583
Category
Other Products
Molecular Weight
395.7317
Molecular Formula
C9H7 N O4
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Specification
Synonyms
2,4-DIOXO-4-PYRIDIN-4-YLBUTANOIC ACID
IUPAC Name
2,4-dioxo-4-pyridin-4-ylbutanoic acid
Canonical SMILES
C1=CN=CC=C1C(=O)CC(=O)C(=O)O
InChI Key
ROQQLNHLFCKPOQ-UHFFFAOYSA-N
Boiling Point
478.5ºC at 760 mmHg
Flash Point
243.2ºC
Density
1.41 g/cm³
Exact Mass
193.03800
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
5
H-Bond Donor
1
What is the molecular formula of 4-Pyridinebutanoicacid, a,g-dioxo-?
The molecular formula of 4-Pyridinebutanoicacid, a,g-dioxo- is C9H7NO4.
What is the molecular weight of 4-Pyridinebutanoicacid, a,g-dioxo-?
The molecular weight of 4-Pyridinebutanoicacid, a,g-dioxo- is 193.16 g/mol.
What is the IUPAC name of 4-Pyridinebutanoicacid, a,g-dioxo-?
The IUPAC name of 4-Pyridinebutanoicacid, a,g-dioxo- is 2,4-dioxo-4-pyridin-4-ylbutanoic acid.
What is the InChI of 4-Pyridinebutanoicacid, a,g-dioxo-?
The InChI of 4-Pyridinebutanoicacid, a,g-dioxo- is InChI=1S/C9H7NO4/c11-7(5-8(12)9(13)14)6-1-3-10-4-2-6/h1-4H,5H2,(H,13,14).
What is the InChIKey of 4-Pyridinebutanoicacid, a,g-dioxo-?
The InChIKey of 4-Pyridinebutanoicacid, a,g-dioxo- is ROQQLNHLFCKPOQ-UHFFFAOYSA-N.
What is the canonical SMILES representation of 4-Pyridinebutanoicacid, a,g-dioxo-?
The canonical SMILES representation of 4-Pyridinebutanoicacid, a,g-dioxo- is C1=CN=CC=C1C(=O)CC(=O)C(=O)O.
What is the CAS number of 4-Pyridinebutanoicacid, a,g-dioxo-?
The CAS number of 4-Pyridinebutanoicacid, a,g-dioxo- is 98589-58-3.
What is the ChEMBL ID of 4-Pyridinebutanoicacid, a,g-dioxo-?
The ChEMBL ID of 4-Pyridinebutanoicacid, a,g-dioxo- is CHEMBL177297.
What is the molecular weight of 4-Pyridinebutanoicacid, a,g-dioxo- according to PubChem?
The molecular weight of 4-Pyridinebutanoicacid, a,g-dioxo- is 193.16 g/mol according to PubChem.
Is 4-Pyridinebutanoicacid, a,g-dioxo- a canonicalized compound?
Yes, 4-Pyridinebutanoicacid, a,g-dioxo- is a canonicalized compound according to PubChem.
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