1-Isopropyl-4-methylpent-1-enyl acetate

CAS

94291-79-9

Catalog Number

ACM94291799

Category

Other Products

Molecular Weight

184.275300 [g/mol]

Molecular Formula

C₁₁H₂₀O₂

MSDS COA Spec Sheet

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Specification

Synonyms

EINECS 304-905-4, 1-Isopropyl-4-methylpent-1-enyl acetate, 94291-79-9

IUPAC Name

[(E)-2,6-dimethylhept-3-en-3-yl] acetate

Canonical SMILES

CC(C)CC=C(C(C)C)OC(=O)C

InChI Key

AYKLIRYFVQAMPD-YRNVUSSQSA-N

Boiling Point

223.6ºC at 760mmHg

Flash Point

73.8ºC

Density

0.886g/cm³

EC Number

304-905-4

Exact Mass

184.14600

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of 1-Isopropyl-4-methylpent-1-enyl acetate?

The molecular formula is C11H20O2.

When was the compound created?

The compound was created on August 20, 2009.

What is the Molecular Weight of 1-Isopropyl-4-methylpent-1-enyl acetate?

The Molecular Weight is 184.27 g/mol.

What is the IUPAC Name of 1-Isopropyl-4-methylpent-1-enyl acetate?

The IUPAC Name is [(E)-2,6-dimethylhept-3-en-3-yl] acetate.

What is the InChIKey of 1-Isopropyl-4-methylpent-1-enyl acetate?

The InChIKey is AYKLIRYFVQAMPD-YRNVUSSQSA-N.

How many Hydrogen Bond Donor Count does 1-Isopropyl-4-methylpent-1-enyl acetate have?

It has 0 Hydrogen Bond Donor Count.

What is the Exact Mass of 1-Isopropyl-4-methylpent-1-enyl acetate?

The Exact Mass is 184.146329876 g/mol.

How many Rotatable Bond Count does 1-Isopropyl-4-methylpent-1-enyl acetate have?

It has 5 Rotatable Bond Count.

Does 1-Isopropyl-4-methylpent-1-enyl acetate have any defined bond stereocenter count?

Yes, it has 1 defined bond stereocenter count.

Is the compound Canonicalized?

Yes, the compound is canonicalized.

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