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Structure

(4-Methoxybutylidene)cyclohexane

CAS
93777-41-4
Catalog Number
ACM93777414
Category
Other Products
Molecular Weight
168.275900 [g/mol]
Molecular Formula
C11H20O

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Specification

Synonyms
(4-Methoxybutylidene)cyclohexane, 93777-41-4, AC1MICZ7, 4-methoxybutylidenecyclohexane, CTK5H3029, EINECS 298-072-3, Cyclohexane, (4-methoxybutylidene)-, AG-H-83258
IUPAC Name
4-methoxybutylidenecyclohexane
Canonical SMILES
COCCCC=C1CCCCC1
InChI Key
VALMDEDTYYMWAS-UHFFFAOYSA-N
Boiling Point
229.7ºC at 760 mmHg
Flash Point
79.3ºC
Density
0.937g/cm³
EC Number
298-072-3
Exact Mass
168.15100
H-Bond Acceptor
1
H-Bond Donor
0
What is the molecular formula of (4-Methoxybutylidene)cyclohexane?

The molecular formula is C11H20O.

When was (4-Methoxybutylidene)cyclohexane created in PubChem?

It was created on August 8, 2005.

How is the IUPAC name of (4-Methoxybutylidene)cyclohexane computed?

The IUPAC name is computed by Lexichem TK 2.7.0.

What is the InChI of (4-Methoxybutylidene)cyclohexane?

The InChI is InChI=1S/C11H20O/c1-12-10-6-5-9-11-7-3-2-4-8-11/h9H,2-8,10H2,1H3.

What is the InChIKey of (4-Methoxybutylidene)cyclohexane?

The InChIKey is VALMDEDTYYMWAS-UHFFFAOYSA-N.

How many hydrogen bond acceptor counts does (4-Methoxybutylidene)cyclohexane have?

It has 1 hydrogen bond acceptor count.

What is the topological polar surface area of (4-Methoxybutylidene)cyclohexane?

The topological polar surface area is 9.2 Ų.

How many rotatable bond counts does (4-Methoxybutylidene)cyclohexane have?

It has 4 rotatable bond counts.

Is (4-Methoxybutylidene)cyclohexane a canonicalized compound in PubChem?

Yes, it is canonicalized.

What is the molecular weight of (4-Methoxybutylidene)cyclohexane?

The molecular weight is 168.28 g/mol.

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