Basic information
- CAS
3295-97-4- Standard SMILES
C=CCOCCCCCCCC- InChIKey
IELYMBBIHQDONA-UHFFFAOYSA-N- Molecular formula
- C11H22O
- Average molar mass
- 170.29 g/mol
- Monoisotopic mass
- 170.16706532
Names & identifiers
- Preferred name
- Allyl n-octyl ether
- IUPAC
- 1-prop-2-enoxyoctane
- English name
- Allyl n-Octyl Ether
- Molecular formula
- C11H22O
- Molecular weight
- 170.29
Names & synonyms
Allyl n-octyl etherAllyl octyl etherDTXSID70334405RefChem:318083DTXCID40285495672-735-0IELYMBBIHQDONA-UHFFFAOYSA-N3295-97-41-(allyloxy)octane1-prop-2-enoxyoctaneMFCD00015294Allyloxyoctane
Show more names
Octyl allyl ether3-(Octyloxy)-1-propeneAllyl n-Octyl Ether >Allyl n-Octyl EtherOctane, 1-(2-propen-1-yloxy)-
allyloctyl ether1-allyloxyoctaneSCHEMBL99221Allyl n-Octyl Ether, 95%3-(Octyloxy)-1-propene #SCHEMBL85921541-[(Prop-2-en-1-yl)oxy]octaneAKOS006228359
Database identifiers
- CAS
3295-97-4- PubChem CID
- 520600
- DTXSID
DTXSID70334405- EC Number
- 672-735-0
- Nikkaji
- J207.962C
Properties
Computed structural properties
- XLogP
- 4.1
- 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
- 89
Physicochemical properties
- Boiling point
- 206 °C · 206 °C
- Density
- 0.81 · 0.81
- refractive index
- 1.426 · 1.4260-1.4300
- form
- clear liquid
- color
- Colorless to Almost colorless
- InChI
- InChI=1S/C11H22O/c1-3-5-6-7-8-9-11-12-10-4-2/h4H,2-3,5-11H2,1H3
- InChIKey
- IELYMBBIHQDONA-UHFFFAOYSA-N
- SMILES
- C(OCC=C)CCCCCCC
- NIST Chemistry Reference
- Allyl n-octyl ether(3295-97-4)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 227 · H227-H315-H319
- Precautionary statements
- 210 · P210-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P370+P378-P403+P235-P501
- HS Code
- 2909.19 · 2909.19.1800
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2909.19.1800
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H227-H315-H319
- Precautionary statements
- P210-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P370+P378-P403+P235-P501
Chemistry & industry
Applications
UsesAllyl n-octyl ether has antibacterial activity and is used as pharmaceutical intermediates[1].
Suppliers32 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
山东李比希生物医药科技有限公司17866677155 · [email protected]
JINING XINHE CHEMICAL CO., LTD+8615318402391 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
TCI AMERICA800-4238616 · [email protected]
Related reactions
3 records
Compound notes
Loading…