CAS
937619-34-6 Purity
96%
937619-34-6 Purity
96%
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N-(2-Butoxyethyl)-4-[(2-chloro-4-Nitrophenyl)azo]-n-ethylaniline
CAS
93762-07-3
Catalog Number
ACM93762073
Category
Other Products
Molecular Weight
404.890500 [g/mol]
Molecular Formula
C20H25ClN4O3
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Specification
Synonyms
EINECS 297-720-2, CID3022199, N-(2-Butoxyethyl)-4-((2-chloro-4-nitrophenyl)azo)-N-ethylaniline, 93762-07-3
IUPAC Name
N-(2-butoxyethyl)-4-[(2-chloro-4-nitrophenyl)diazenyl]-N-ethylaniline
Canonical SMILES
CCCCOCCN(CC)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl
InChI Key
AYIHOZYLPZMNPR-UHFFFAOYSA-N
Boiling Point
546.5ºC at 760mmHg
Flash Point
284.3ºC
Density
1.2g/cm³
EC Number
297-720-2
Exact Mass
404.16200
H-Bond Acceptor
6
H-Bond Donor
0
What is the molecular formula of N-(2-Butoxyethyl)-4-[(2-chloro-4-Nitrophenyl)azo]-n-ethylaniline?
The molecular formula is C20H25ClN4O3.
When was N-(2-Butoxyethyl)-4-[(2-chloro-4-Nitrophenyl)azo]-n-ethylaniline created?
It was created on August 8, 2005.
What is the InChIKey of N-(2-Butoxyethyl)-4-[(2-chloro-4-Nitrophenyl)azo]-n-ethylaniline?
The InChIKey is AYIHOZYLPZMNPR-UHFFFAOYSA-N.
How many hydrogen bond acceptor counts does N-(2-Butoxyethyl)-4-[(2-chloro-4-Nitrophenyl)azo]-n-ethylaniline have?
It has 6 hydrogen bond acceptor counts.
What is the topological polar surface area of N-(2-Butoxyethyl)-4-[(2-chloro-4-Nitrophenyl)azo]-n-ethylaniline?
The topological polar surface area is 83.2.
Is N-(2-Butoxyethyl)-4-[(2-chloro-4-Nitrophenyl)azo]-n-ethylaniline a canonical compound?
Yes, it is a canonical compound.
What is the molecular weight of N-(2-Butoxyethyl)-4-[(2-chloro-4-Nitrophenyl)azo]-n-ethylaniline?
The molecular weight is 404.9 g/mol.
How many rotatable bond counts does N-(2-Butoxyethyl)-4-[(2-chloro-4-Nitrophenyl)azo]-n-ethylaniline have?
It has 10 rotatable bond counts.
What is the XLogP3-AA value of N-(2-Butoxyethyl)-4-[(2-chloro-4-Nitrophenyl)azo]-n-ethylaniline?
The XLogP3-AA value is 5.7.
What is the exact mass of N-(2-Butoxyethyl)-4-[(2-chloro-4-Nitrophenyl)azo]-n-ethylaniline?
The exact mass is 404.1615184 g/mol.
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