Structure

1,3,5-Triethylbenzene

CAS
102-25-0
Catalog Number
ACM102250
Category
Arenes
Molecular Weight
162.27
Molecular Formula
C12H18

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Specification

Synonyms
Benzene, 1,3,5-triethyl-
Complexity
81
Defined Atom Stereocenter Count
0
Exact Mass
162.1408
Formal Charge
0
Hazard Statements
H302-H317
Heavy Atom Count
12
Hydrogen Bond Acceptor Count
0
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Monoisotopic Mass
162.1408
RIDADR
UN 3077 9 / PGIII
Rotatable Bond Count
3
Symbol
GHS07
Topological Polar Surface Area
0 Ų
XLogP3-AA
4.3
What is the molecular formula of 1,3,5-Triethylbenzene?

The molecular formula of 1,3,5-Triethylbenzene is C12H18.

What is the molecular weight of 1,3,5-Triethylbenzene?

The molecular weight of 1,3,5-Triethylbenzene is 162.27 g/mol.

When was 1,3,5-Triethylbenzene created?

1,3,5-Triethylbenzene was created on March 26, 2005.

What is the InChI of 1,3,5-Triethylbenzene?

The InChI of 1,3,5-Triethylbenzene is InChI=1S/C12H18/c1-4-10-7-11(5-2)9-12(6-3)8-10/h7-9H,4-6H2,1-3H3.

What is the InChIKey of 1,3,5-Triethylbenzene?

The InChIKey of 1,3,5-Triethylbenzene is WJYMPXJVHNDZHD-UHFFFAOYSA-N.

What is the Canonical SMILES of 1,3,5-Triethylbenzene?

The Canonical SMILES of 1,3,5-Triethylbenzene is CCC1=CC(=CC(=C1)CC)CC.

What is the CAS number of 1,3,5-Triethylbenzene?

The CAS number of 1,3,5-Triethylbenzene is 102-25-0.

What is the XLogP3-AA value of 1,3,5-Triethylbenzene?

The XLogP3-AA value of 1,3,5-Triethylbenzene is 4.3.

Is 1,3,5-Triethylbenzene a canonicalized compound?

Yes, 1,3,5-Triethylbenzene is canonicalized.

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