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Structure

1-Ethoxy-4-(trans-4-propylcyclohexyl)benzene

CAS
80944-44-1
Catalog Number
ACM80944441
Category
Other Products
Molecular Weight
246.39
Molecular Formula
C17H26O

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Specification

IUPAC Name
1-ethoxy-4-(4-propylcyclohexyl)benzene
Canonical SMILES
CCCC1CCC(CC1)C2=CC=C(C=C2)OCC
InChI
InChI=1S/C17H26O/c1-3-5-14-6-8-15(9-7-14)16-10-12-17(13-11-16)18-4-2/h10-15H,3-9H2,1-2H3
InChI Key
OXBRRUNAAVNTOZ-UHFFFAOYSA-N
Boiling Point
345.3 °C / 760 mmHg
Melting Point
42 °C
Appearance
White to Light yellow powder to crystal
Storage
Sealed in dry. Room temperature.
Complexity
210
Covalently-Bonded Unit Count
1
EC Number
279-633-1
Exact Mass
246.198365g/mol
Formal Charge
0
Hazard Statements
H302
H-Bond Acceptor
1
H-Bond Donor
0
Heavy Atom Count
18
MDL Number
MFCD06658195
Monoisotopic Mass
246.198365g/mol
Precautionary Statements
P280-P305+P351+P338
Refractive Index
1.48
Rotatable Bond Count
5
Signal Word
Warning
Specific Gravity
0.92
XLogP3
6.1
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