Structure

3-Ethyltoluene

CAS
620-14-4
Catalog Number
ACM620144
Category
Arenes
Molecular Weight
120.19
Molecular Formula
C9H12

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Specification

Synonyms
1-Ethyl-3-methylbenzene
Complexity
76
Defined Atom Stereocenter Count
0
Exact Mass
120.0939
Formal Charge
0
Hazard Statements
H301
Heavy Atom Count
9
Hydrogen Bond Acceptor Count
0
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Monoisotopic Mass
120.0939
RIDADR
UN 3295C 3 / PGIII
Rotatable Bond Count
1
Symbol
GHS06
Topological Polar Surface Area
0 Ų
XLogP3-AA
3.6
What is the molecular formula of 3-ethyltoluene?

The molecular formula of 3-ethyltoluene is C9H12.

What is the molecular weight of 3-ethyltoluene?

The molecular weight of 3-ethyltoluene is 120.19 g/mol.

What are some synonyms for 3-ethyltoluene?

Some synonyms for 3-ethyltoluene include 1-Ethyl-3-methylbenzene and M-ETHYLTOLUENE.

What is the IUPAC name of 3-ethyltoluene?

The IUPAC name of 3-ethyltoluene is 1-ethyl-3-methylbenzene.

What is the InChIKey of 3-ethyltoluene?

The InChIKey of 3-ethyltoluene is ZLCSFXXPPANWQY-UHFFFAOYSA-N.

What is the canonical SMILES of 3-ethyltoluene?

The canonical SMILES of 3-ethyltoluene is CCC1=CC=CC(=C1)C.

What is the CAS number of 3-ethyltoluene?

The CAS number of 3-ethyltoluene is 620-14-4.

What is the XLogP3 value of 3-ethyltoluene?

The XLogP3 value of 3-ethyltoluene is 3.6.

How many rotatable bonds does 3-ethyltoluene have?

3-ethyltoluene has 1 rotatable bond.

What is the topological polar surface area of 3-ethyltoluene?

The topological polar surface area of 3-ethyltoluene is 0Ų.

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