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Structure

2-Ethyl-1-benzofuran-3-carbaldehyde oxime

CAS
92287-69-9
Catalog Number
ACM92287699
Category
Other Products
Molecular Weight
189.210540 [g/mol]
Molecular Formula
C11H11NO2

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Specification

Synonyms
ZINC04218435, CID7130947, 92287-69-9
IUPAC Name
(NZ)-N-[(2-ethyl-1-benzofuran-3-yl)methylidene]hydroxylamine
Canonical SMILES
CCC1=C(C2=CC=CC=C2O1)C=NO
InChI Key
BUKQODPEAREPPX-GHXNOFRVSA-N
Boiling Point
311.6ºC at 760mmHg
Flash Point
142.3ºC
Density
1.18g/cm³
Exact Mass
189.07900
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 2-Ethyl-1-benzofuran-3-carbaldehyde oxime?

The molecular formula is C11H11NO2.

What is the molecular weight of 2-Ethyl-1-benzofuran-3-carbaldehyde oxime?

The molecular weight is 189.21 g/mol.

What is the IUPAC name of 2-Ethyl-1-benzofuran-3-carbaldehyde oxime?

The IUPAC name is (NE)-N-[(2-ethyl-1-benzofuran-3-yl)methylidene]hydroxylamine.

What is the InChI of 2-Ethyl-1-benzofuran-3-carbaldehyde oxime?

The InChI is InChI=1S/C11H11NO2/c1-2-10-9(7-12-13)8-5-3-4-6-11(8)14-10/h3-7,13H,2H2,1H3/b12-7+.

What is the InChIKey of 2-Ethyl-1-benzofuran-3-carbaldehyde oxime?

The InChIKey is BUKQODPEAREPPX-KPKJPENVSA-N.

What is the canonical SMILES of 2-Ethyl-1-benzofuran-3-carbaldehyde oxime?

The canonical SMILES is CCC1=C(C2=CC=CC=C2O1)C=NO.

What is the isomeric SMILES of 2-Ethyl-1-benzofuran-3-carbaldehyde oxime?

The isomeric SMILES is CCC1=C(C2=CC=CC=C2O1)/C=N/O.

What is the XLogP3-AA value of 2-Ethyl-1-benzofuran-3-carbaldehyde oxime?

The XLogP3-AA value is 2.9.

How many hydrogen bond donor counts does 2-Ethyl-1-benzofuran-3-carbaldehyde oxime have?

It has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 2-Ethyl-1-benzofuran-3-carbaldehyde oxime have?

It has 3 hydrogen bond acceptor counts.

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