Tri-p-tolyl Phosphite

CAT: 0024-sc-484900Size: 25 gDry Ice: NoHazardous: No

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CAT#:0024-sc-484900Size:25 g

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CAS Number

620-42-8

Chemical Information

Phosphorous acid, tris(methylphenyl) ester

CAS Number	620-42-8
PubChem CID	12106
IUPAC Name	tris(4-methylphenyl) phosphite
Molecular Formula	C21H21O3P
Molecular Weight	352.4
XLogP	6.6
Topological Polar Surface Area	27.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Heavy Atom Count	25
Formal Charge	0
Complexity	310

SMILES

CC1=CC=C(C=C1)OP(OC2=CC=C(C=C2)C)OC3=CC=C(C=C3)C

InChI

InChI=1S/C21H21O3P/c1-16-4-10-19(11-5-16)22-25(23-20-12-6-17(2)7-13-20)24-21-14-8-18(3)9-15-21/h4-15H,1-3H3

InChIKey

FEVFLQDDNUQKRY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 620-42-8

CID: 12106

Formula: C21H21O3P

MW: 352.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	352.4
XLogP3	6.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Exact Mass	352.12283153
Monoisotopic Mass	352.12283153
Topological Polar Surface Area	27.7 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	310
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
sc-272708	Tri (o-tolyl) phosphite
sc-237241	Tri (p-tolyl) phosphine
sc-258281	Tri (o-tolyl) phosphine
sc-237240	Tri (m-tolyl) phosphine
sc-213101	Tri (methyl) Phosphite-d9
sc-223947	Diphenyl (p-tolyl) phosphine
sc-498387	Di-p-tolyl-phosphate
sc-485706	Tri-o-tolyl Borate
sc-296597	Tri-p-cresyl Phosphate
sc-236282B	P-Tolyl trifluoromethanesulfonate

Catalog	Name
T32375	Tri-P-Tolyl Phosphite
OR1015359-01	Tri-O-Tolyl Phosphite
TRC-P049950-250MG	Tri(nonylphenyl) Phosphite
QAA20562-01	Tri (tert-butyl) phosphite
290676-01	Tri-p-tolyl phosphine
T32385	Tri-p-Tolyl thiophosphate
HY-W654319	Tri-p-tolyl phosphate-d21
IN12047-01	Chloro[Tri (P-Tolyl) Phosphine]Gold (I)
OR75577-01	Tri-o-tolyl phosphate
291706-01	Tri (o-tolyl) phosphine