Oleic aldehyde dimethyl acetal

Catalog Number	ACM15677711
CAS	15677-71-1
Structure
Synonyms	18:1 Dimethylacetal
IUPAC Name	1,1-Dimethoxyoctadec-9-ene
Molecular Weight	312.5
Molecular Formula	C20H40O2
Canonical SMILES	CCCCCCCCC=CCCCCCCCC(OC)OC
InChI	InChI=1S/C20H40O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21-2)22-3/h11-12,20H,4-10,13-19H2,1-3H3
InChI Key	WBNMCUYSZJIEFY-UHFFFAOYSA-N
Purity	99+%
Complexity	222
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Exact Mass	312.302830514
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Monoisotopic Mass	312.302830514
Physical State	Liquid
Rotatable Bond Count	17
Storage Conditions	-20 °C
Topological Polar Surface Area	18.5 Ų

Knowledge & Learning Case Study Q&A

What is the molecular formula of Oleic aldehyde dimethyl acetal?

The molecular formula is C20H40O2.

What is the IUPAC name of Oleic aldehyde dimethyl acetal?

The IUPAC name is (Z)-1,1-dimethoxyoctadec-9-ene.

What is the exact mass of Oleic aldehyde dimethyl acetal?

The exact mass is 312.302830514.

How many hydrogen bond acceptors does Oleic aldehyde dimethyl acetal have?

It has 2 hydrogen bond acceptors.

What is the XLogP3 value of Oleic aldehyde dimethyl acetal?

The XLogP3 value is 8.

What is the Canonical SMILES of Oleic aldehyde dimethyl acetal?

The Canonical SMILES is CCCCCCCCC=CCCCCCCCC(OC)OC.

What is the Computed Properties Rotatable Bond Count of Oleic aldehyde dimethyl acetal?

The Rotatable Bond Count is 17.

What is the InChIKey of Oleic aldehyde dimethyl acetal?

The InChIKey is WBNMCUYSZJIEFY-QXMHVHEDSA-N.

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