Methyl 10-undecenoate - CAS 111-81-9

Catalog:	BB002813
Product Name:	Methyl 10-undecenoate
CAS:	111-81-9
Synonyms:	methyl undec-10-enoate

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Computed Properties

IUPAC Name:	methyl undec-10-enoate
Description:	Methyl 10-undecenoate (CAS# 111-81-9) is a useful research chemical compound.
Molecular Weight:	198.30
Molecular Formula:	C12H22O2
Canonical SMILES:	COC(=O)CCCCCCCCC=C
InChI:	InChI=1S/C12H22O2/c1-3-4-5-6-7-8-9-10-11-12(13)14-2/h3H,1,4-11H2,2H3
InChI Key:	KISVAASFGZJBCY-UHFFFAOYSA-N
Boiling Point:	245 °C
Melting Point:	27.5 °C
Purity:	> 95 %
Density:	0.88 g/cm³
Solubility:	slightly
Appearance:	Solid
MDL:	MFCD00016689
LogP:	3.46620

Publication Number	Title	Priority Date
CN-113292451-A	Compound with photoresponse, preparation method thereof, palladium or nickel compound	20210604
CN-113024787-A	Method for catalyzing ring-opening polymerization of epsilon-caprolactone by using [ OSSO ] type complex	20210317
CN-112898464-A	Polar polyolefin material and preparation method and application thereof	20210120
CN-111841610-A	Electron-rich single-atom Pt alloy intermetallic compound catalyst and preparation method thereof	20200804
EP-3888790-A1	Hydroformylation catalyst system with syngas surrogate	20200401

PMID	Publication Date	Title	Journal
21567600	20101018	Fatty Acid Derived Monomers and Related Polymers Via Thiol-ene (Click) Additions	Macromolecular rapid communications
20055368	20100202	Spontaneous formation of densely stacked multilamellar vesicles in dioctadecyldimethylammonium bromide/oleosiloxane mixtures	Langmuir : the ACS journal of surfaces and colloids
19919135	20091125	Highly Z-selective metathesis homocoupling of terminal olefins	Journal of the American Chemical Society
19296684	20090413	Amphiphilic polyesters derived from silylated and germylated fatty compounds	Biomacromolecules
19146429	20090217	Covalently attached organic monolayers on SiC and SixN4 surfaces: formation using UV light at room temperature	Langmuir : the ACS journal of surfaces and colloids

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P273, P301+P312, P304+P312, P304+P340, P312, P330, P391, and P501
Signal Word:	Warning

Complexity:	152
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	198.161979940
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	198.161979940
Rotatable Bond Count:	10
Topological Polar Surface Area:	26.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4.2