Dimethyl Phthalate 99% For Synthesis

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CAS Number

131-11-3

HSN Code

29173940

Chemical Information

Dimethyl Phthalate

Dimethyl phthalate is a methyl ester, a phthalate ester and a diester.

CAS Number	131-11-3
PubChem CID	8554
IUPAC Name	dimethyl benzene-1,2-dicarboxylate
Molecular Formula	C10H10O4
Molecular Weight	194.18
XLogP	1.6
Topological Polar Surface Area	52.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	14
Formal Charge	0
Complexity	200

SMILES

COC(=O)C1=CC=CC=C1C(=O)OC

InChI

InChI=1S/C10H10O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h3-6H,1-2H3

InChIKey

NIQCNGHVCWTJSM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 131-11-3

CID: 8554

Formula: C10H10O4

MW: 194.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	194.18
XLogP3	1.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	194.05790880
Monoisotopic Mass	194.05790880
Topological Polar Surface Area	52.6 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	200
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
01005 02500	Diethyl Phthalate 99% For Synthesis
100502500	Diethyl Phthalate 99% For Synthesis
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00961 00500	Dibutyl Phthalate 99% For Synthesis
100500500	Diethyl Phthalate 99% For Synthesis
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Catalog	Name
01045 00500	Dimethyl Phthalate 99% For Synthesis
LC-10576.1	Diisodecyl phthalate for synthesis
104800 2.5-01	Dioctyl Phthalate For Synthesis
028142-01	Diethyl Phthalate for Synthesis
064005-01	Diallyl Phthalate for Synthesis
FD62526	Dimethyl Phthalate