Dibutyl azelate

CAT: 1596-AR-A03305-02Size: 100 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-A03305-02Size:100 Units

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CAS Number

2917-73-9

Synonyms

Ergoplast AzDB; NSC 93294; Dibutyl Ester Nonanedioic Acid

Molecular Formula

C17H32O4

Molecular Weight

300.43

API Name

Miscellaneous

Chemical Information

Dibutyl azelate

CAS Number	2917-73-9
PubChem CID	18016
IUPAC Name	dibutyl nonanedioate
Molecular Formula	C17H32O4
Molecular Weight	300.4
XLogP	4.7
Topological Polar Surface Area	52.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	16
Heavy Atom Count	21
Formal Charge	0
Complexity	238

SMILES

CCCCOC(=O)CCCCCCCC(=O)OCCCC

InChI

InChI=1S/C17H32O4/c1-3-5-14-20-16(18)12-10-8-7-9-11-13-17(19)21-15-6-4-2/h3-15H2,1-2H3

InChIKey

RISLXYINQFKFRL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2917-73-9

CID: 18016

Formula: C17H32O4

MW: 300.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	300.4
XLogP3	4.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	16
Exact Mass	300.23005950
Monoisotopic Mass	300.23005950
Topological Polar Surface Area	52.6 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	238
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
TRC-D470635-50G	Dimethyl Azelate
OR1013911-01	Monomethyl Azelate
TRC-D400120-1G	Dioctyl Azelate
TRC-D447785-5MG	Dihexyl Azelate
RG-A261691-01	Diethyl Azelate
MBS5790848	Methyl hydrogen azelate
TRC-D400121-100MG	Dioctyl Azelate-D₃₄
TRC-E454750-100MG	Triethyl Cromoglicate Azelate
sc-235886	Mono-Methyl azelate
D37370-01	Dimethyl azelate 90%