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Decane, 1-methoxy-

HCID 23716
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
68989-91-3
Standard SMILES
CCCCCCCCCCOC
InChIKey
JPEWDCTZJFUITH-UHFFFAOYSA-N
Molecular formula
C11H24O
Average molar mass
172.31 g/mol
Monoisotopic mass
172.18271539

Names & identifiers

Preferred name
Decane, 1-methoxy-
IUPAC
1-methoxydecane
English name
1-Methoxydecane
Molecular formula
C11H24O
Molecular weight
172.31

Names & synonyms

1-MethoxydecaneDecane, 1-methoxy-Decyl methyl etherEINECS 230-718-1BRN 1736529DTXSID60646163-01-00-01760 (Beilstein Handbook Reference)RefChem:131180DTXCID5047378230-718-1JPEWDCTZJFUITH-UHFFFAOYSA-N7289-52-3
Show more names
1-methoxy-decanMethoxy Decanemethyldecyletherether,decylmethylmethyln-decylether
Methyl decyl etherMethyl n-decyl ether1-methoxy-DecaneETHER, DECYL METHYL2-oxadodecanen-Decyl Methyl EtherSCHEMBL92142SCHEMBL199532

Database identifiers

CAS
68989-91-3、7289-52-3
PubChem CID
23716
DTXSID
DTXSID6064616
EC Number
230-718-1
Nikkaji
J75.049B

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
9
Heavy atoms
12
Formal charge
0
Complexity
71.4

Experimental & physicochemical properties

SpringerMaterials PropertiesBoiling point

Physicochemical properties

Melting point
189 °C · 189 °C
Boiling point
202.66 °C · 202.66°C (estimate)
Density
0.7977 · 0.7977 (estimate)
refractive index
1.4102 · 1.4102 (estimate)
storage temp.
Refrigerator
solubility
Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
form
Oil
color
Colourless to Light Yellow
Odor
100 % · at 100.00 %. fresh air clean laundered cloths sweet
Odor Type
fresh
Cosmetics Ingredients Functions
PERFUMING
LogP
4.607 · 4.607 (est)
EWG's Food Scores

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 3 items

This chemical does not meet GHS hazard criteria for 100% (89 of 89) of all reports.

Not Classified

Aggregated GHS information provided per 89 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 2 items

Chemical: Decane, 1-methoxy-

Decane, 1-methoxy-: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - Decane, 1-methoxy-: Human health tier I assessment
Hazard Classes and CategoriesNot Classified

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationDecane, 1-methoxy-: ACTIVE

Applications

Uses1-METHOXYDECANE is a fatty ether used as a possible diesel fuel extenders.

UsesFragrance/Aroma compound with a fresh scent. Decyl Methyl Ether is a fatty ether used as a possible diesel fuel extender.

Suppliers31 total

艾吉析科技(上海)有限公司17717235263 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
United Life Science020-82099279 18988968278 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海陶素生化科技有限公司021-33632979 · [email protected]
石家庄琪跃化工有限公司15369111890 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
TLC梯尔希(南京)药物研发有限公司18012923235 · [email protected]
凯试(上海)科技有限公司

Related reactions

3 records
New reaction record
HRID 248662 reaction equation
HRID 248662As productuspto-grants-1993_05
HRID 373671 reaction equation
HRID 373671As productuspto-grants-1992_11
HRID 1153141 reaction equation
HRID 1153141As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
1 · 1
EPA Substance Registry System
1 · Decane, 1-methoxy- (7289-52-3)
TSCA
TSCA listed
021-50135380 · [email protected]
池州凯隆进出口贸易有限公司[email protected]
普善实业(陕西)有限公司029-81310890 18165209495 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
湖北恒绿源科技有限公司027-88188016 18717196322 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
BOC Sciences[email protected]
深圳市祥根生物医药有限公司0755-28967200 13631290199 · [email protected]
Shaanxi Dideu New Materials Co. Ltd18192503167 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
LYSCHEM International LLC13911018262 · [email protected]
TargetMol中国(陶术生物)4008200310 15002144251 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
河南科弘生物科技有限公司0371-55969461 18638736641 · [email protected]
武汉泰易成生化药业有限公司027-88320699 ;15307126061 · [email protected]
深圳利斯康医药科技有限公司+86-0755-89396905 +86-18025329037 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]