1-(3,7-Dimethyloctoxy)-4-methoxybenzene

HCID 5153591
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Basic information

CAS
209347-80-8
Standard SMILES
COc1ccc(OCCC(C)CCCC(C)C)cc1
InChIKey
TVTKIXDRBOYDJT-UHFFFAOYSA-N
Molecular formula
C17H28O2
Average molar mass
264.4 g/mol
Monoisotopic mass
264.20893013

Names & identifiers

Preferred name
1-(3,7-Dimethyloctoxy)-4-methoxybenzene
IUPAC
1-(3,7-dimethyloctoxy)-4-methoxybenzene
English name
1-METHOXY-4-(3' 7'-(DIMETHYLOCTYL)OXY)B&
Molecular formula
C17H28O2
Molecular weight
264.4

Names & synonyms

1-(3,7-dimethyloctoxy)-4-methoxybenzene209347-80-8DTXSID30408939RefChem:224116DTXCID903597911-[(3,7-dimethyloctyl)oxy]-4-methoxybenzeneSCHEMBL1628659SCHEMBL4966397TVTKIXDRBOYDJT-UHFFFAOYSA-N1-methoxy-4-(3,7-dimethyloctyloxy)benzene1-METHOXY-4-(3' 7'-(DIMETHYLOCTYL)OXY)B&Benzene, 1-[(3,7-dimethyloctyl)oxy]-4-methoxy-
Show more names
1-[(3,7-Dimethyloctyl)oxy]-4-methoxybenzene, 98%

Database identifiers

CAS
209347-80-8
PubChem CID
5153591
DTXSID
DTXSID30408939

Properties

Computed structural properties

XLogP
6
Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
9
Heavy atoms
19

Physicochemical properties

Boiling point
135 · 135-140 °C10 mm Hg(lit.)
Density
0.922 g/mL · 0.922 g/mL at 25 °C(lit.)
refractive index
20 · n20/D 1.4915(lit.)
Flash point
230 °F · >230 °F
WGK Germany
3 · 3

Safety & regulation

Safety data

wgk
3

Chemistry & industry

Suppliers3 total

西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMA—
SIGMAALDRICH—

Related reactions

1 records
New reaction record

Compound notes

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