Trimethyl Orthovalerate

CAT: 0572-TRC-T796575-50GSize: 50 gDry Ice: NoHazardous: Yes

1 / 1

CAT#:0572-TRC-T796575-50GSize:50 g

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

13820-09-2

Synonyms

1,1,1-Trimethoxypentane; Orthovaleric Acid Trimethyl Ester; Trimethyl Orthopentanoate

Hazard Statement

Flammable liquid and vapour; UN number: UN3272; Packing Group: III

Purity

>95% (GC)

Smiles

CCCCC(OC)(OC)OC

Molecular Formula

C8H18O3

Molecular Weight

162.23

Shipping Conditions

Room Temperature

Storage Conditions

+4°C

Chemical Information

Trimethyl orthovalerate

CAS Number	13820-09-2
PubChem CID	83755
IUPAC Name	1,1,1-trimethoxypentane
Molecular Formula	C8H18O3
Molecular Weight	162.23
XLogP	1.7
Topological Polar Surface Area	27.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Heavy Atom Count	11
Formal Charge	0
Complexity	81

SMILES

CCCCC(OC)(OC)OC

InChI

InChI=1S/C8H18O3/c1-5-6-7-8(9-2,10-3)11-4/h5-7H2,1-4H3

InChIKey

XUXVVQKJULMMKX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 13820-09-2

CID: 83755

Formula: C8H18O3

MW: 162.23

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	162.23
XLogP3	1.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Exact Mass	162.125594432
Monoisotopic Mass	162.125594432
Topological Polar Surface Area	27.7 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	81.1
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
TRC-C696645-1G	Cyclic Methyl Orthovalerate Cortisone
TRC-T796495-5G	Trimethyl Phosphite
T795945	Trimethyl Arsenate
TRC-T796505-50ML	Trimethyl Orthoacetate
TRC-T798150-1G	Trimethyl Orthomethoxyacetate
TRC-T796515-5G	Trimethyl Orthobenzoate
TRC-T796490-500G	Trimethyl Orthoformate
TRC-T796515-10G	Trimethyl Orthobenzoate
TRC-T797605-1G	Trimethyl Thiophosphate
TRC-T796645-250G	Trimethyl Phosphate

Alternative Products

Catalog	Name
FT11272-01	Trimethyl orthovalerate
11912910 100	Trimethyl Orthovalerate for Synthesis
249405-01	Trimethyl Orthovalerate for Synthesis 97.0%
sc-474960	Triethyl Orthovalerate
820007	TRIMETHYL BROMO SILANE (TRIMETHYL SILYL BROMIDE)
FT60564-01	Trimethyl orthoformate
FT45514-01	Trimethyl orthoacetate
620003	TRIMETHYL ORTHOBUTYRATE
591851	Trimethyl orthobeznoate
RG-A261584-01	Trimethyl Borate

Trimethyl Orthovalerate

Chemical Information

Related Products

Alternative Products

Popular Products