Dioctyl Methylphosphonate

CAT: 1596-AR-P31467-06Size: 250 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-P31467-06Size:250 Units

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CAS Number

1832-68-4

Molecular Formula

C17H37O3P

Molecular Weight

320.45

API Name

Phosphonic acid

Chemical Information

Dioctyl methylphosphonate

CAS Number	1832-68-4
PubChem CID	15779
IUPAC Name	1-[methyl(octoxy)phosphoryl]oxyoctane
Molecular Formula	C17H37O3P
Molecular Weight	320.4
XLogP	6.3
Topological Polar Surface Area	35.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	16
Heavy Atom Count	21
Formal Charge	0
Complexity	234

SMILES

CCCCCCCCOP(=O)(C)OCCCCCCCC

InChI

InChI=1S/C17H37O3P/c1-4-6-8-10-12-14-16-19-21(3,18)20-17-15-13-11-9-7-5-2/h4-17H2,1-3H3

InChIKey

QNNWHJRQILFWHD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1832-68-4

CID: 15779

Formula: C17H37O3P

MW: 320.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	320.4
XLogP3	6.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	16
Exact Mass	320.24803204
Monoisotopic Mass	320.24803204
Topological Polar Surface Area	35.5 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	234
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

Catalog	Name
AR-M02590-01	Diphenyl Methylphosphonate
AR-B06643-01	Dioctyl Terephthalate
AR-M03564-01	Dioctyl carbonate
AR-D06590-01	Dioctyl Decanedioate
AR-M05403-01	Bis (2-isopropyl-5methylcyclohexyl) methylphosphonate
AR-G02396-01	5,5-Dioctyl-5H-dithieno[3,2-b:2',3'-d]pyran
AR-M05414-01	Bis[ (1R,2S,5R) -5-methyl-2- (1-methylethyl) cyclohexyl] P-methylphosphonate Phosphonic acid
AR-M03619-01	Diethyl methylphosphonite

Catalog	Name
TRC-P457305-1G	Pinacolyl Methylphosphonate
TRC-D492115-1G	Diphenyl Methylphosphonate
TRC-E924886-100MG	Ethyl Methylphosphonate
D42100	Dimethyl methylphosphonate
446852-01	Diethyl Methylphosphonate
sc-268917	Diisopropyl methylphosphonate
RG-E141574-01	Isopropyl methylphosphonate
RG-E141576-01	Cyclohexyl methylphosphonate
sc-278969	Diisobutyl methylphosphonate
447290-01	Dioctyl Phenylphosphonate