CAS
963-14-4 Purity
96%
963-14-4 Purity
96%
![N-[2-[2-[2-[Bis(2-methoxy-2-oxoethyl)amino]-5-formylphenoxy]ethoxy]-4-methylphenyl]-N-(2-methoxy-2-oxoethyl)-glycine methyl ester](https://resource.alfa-chemistry.com/structure/96315-11-6.gif)
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Benzene,4-methyl-1-nitro-2-[2-(2-nitrophenoxy)ethoxy]-
CAS
96315-08-1
Catalog Number
ACM96315081
Category
Other Products
Molecular Weight
318.28
Molecular Formula
C15H14N2O6
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Specification
Synonyms
4-METHYL-1-NITRO-2-[2-(2-NITROPHENOXY)ETHOXY]-BENZENE
IUPAC Name
4-methyl-1-nitro-2-[2-(2-nitrophenoxy)ethoxy]benzene
Canonical SMILES
CC1=CC(=C(C=C1)[N+](=O)[O-])OCCOC2=CC=CC=C2[N+](=O)[O-]
InChI Key
TUEJQXRXZOFGGX-UHFFFAOYSA-N
Boiling Point
512.4ºC at 760 mmHg
Flash Point
225ºC
Density
1.335g/cm³
Exact Mass
318.08500
H-Bond Acceptor
6
H-Bond Donor
0
What is the molecular formula of Benzene, 4-methyl-1-nitro-2-[2-(2-nitrophenoxy)ethoxy]-?
The molecular formula is C15H14N2O6.
When was this compound created in PubChem?
It was created on July 19, 2005.
What is the molecular weight of Benzene, 4-methyl-1-nitro-2-[2-(2-nitrophenoxy)ethoxy]?
The molecular weight is 318.28 g/mol.
What is the SMILES notation of Benzene, 4-methyl-1-nitro-2-[2-(2-nitrophenoxy)ethoxy]?
The Canonical SMILES is CC1=CC(=C(C=C1)[N+](=O)[O-])OCCOC2=CC=CC=C2[N+](=O)[O-].
How many hydrogen bond acceptors does this compound have?
It has 6 hydrogen bond acceptors.
What is the exact mass of Benzene, 4-methyl-1-nitro-2-[2-(2-nitrophenoxy)ethoxy]?
The exact mass is 318.08518617 g/mol.
Does Benzene, 4-methyl-1-nitro-2-[2-(2-nitrophenoxy)ethoxy] have any isotope atom count?
No, it does not have any isotope atom count.
How many rotatable bond counts does this compound have?
It has 5 rotatable bond counts.
Is Benzene, 4-methyl-1-nitro-2-[2-(2-nitrophenoxy)ethoxy] a canonicalized compound?
Yes, it is a canonicalized compound.
What is the IUPAC name of Benzene, 4-methyl-1-nitro-2-[2-(2-nitrophenoxy)ethoxy]?
The IUPAC name is 4-methyl-1-nitro-2-[2-(2-nitrophenoxy)ethoxy]benzene.
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