CAS
959239-81-7 Purity
96%
959239-81-7 Purity
96%
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2-(2-Furyl)-5-pyrimidinecarbaldehyde
CAS
959240-19-8
Catalog Number
ACM959240198
Category
Other Products
Molecular Weight
174.156140 [g/mol]
Molecular Formula
C9H6N2O2
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Specification
Synonyms
Ambcb4026765, CTK5H8396, ZINC19091905, AKOS000284206, AG-H-94432, 2-(2-FURYL)-5-PYRIMIDINECARBALDEHYDE, 959240-19-8
IUPAC Name
2-(furan-2-yl)pyrimidine-5-carbaldehyde
Canonical SMILES
C1=COC(=C1)C2=NC=C(C=N2)C=O
InChI Key
OFPMHCQBKLJXEX-UHFFFAOYSA-N
Boiling Point
214.2ºC at 760 mmHg
Flash Point
83.4ºC
Density
1.284g/cm³
Exact Mass
174.04300
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of 2-(2-Furyl)-5-pyrimidinecarbaldehyde?
The molecular formula is C9H6N2O2.
When was the compound created and last modified?
The compound was created on May 28, 2009, and last modified on December 30, 2023.
What is the IUPAC name of the compound?
The IUPAC name is 2-(furan-2-yl)pyrimidine-5-carbaldehyde.
What is the InChIKey of the compound?
The InChIKey is OFPMHCQBKLJXEX-UHFFFAOYSA-N.
How many hydrogen bond donor counts does the compound have?
The compound has 0 hydrogen bond donor counts.
What is the exact mass of the compound?
The exact mass is 174.042927438 g/mol.
How many topological polar surface areas does the compound have?
The compound has a topological polar surface area of 56 Ų.
How many heavy atoms are present in the compound?
There are 13 heavy atoms present in the compound.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the formal charge of the compound?
The formal charge of the compound is 0.
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