Structure

Isopropylcyclohexane

CAS
696-29-7
Catalog Number
ACM696297
Category
Alkanes
Molecular Weight
126.24
Molecular Formula
C9H18

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Specification

Synonyms
Hexahydrocumene
Complexity
68
Defined Atom Stereocenter Count
0
Exact Mass
126.1408
Formal Charge
0
Hazard Statements
H225-H304-H315-H336-H410
Heavy Atom Count
9
Hydrogen Bond Acceptor Count
0
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Monoisotopic Mass
126.1408
RIDADR
UN 2922 6.1(8) / PGIII
Rotatable Bond Count
1
Symbol
GHS02
Topological Polar Surface Area
0 Ų
XLogP3-AA
4.3
What is the molecular formula of isopropylcyclohexane?

The molecular formula of isopropylcyclohexane is C9H18.

What is the molecular weight of isopropylcyclohexane?

The molecular weight of isopropylcyclohexane is 126.24 g/mol.

What is the IUPAC name of isopropylcyclohexane?

The IUPAC name of isopropylcyclohexane is propan-2-ylcyclohexane.

What is the InChI of isopropylcyclohexane?

The InChI of isopropylcyclohexane is InChI=1S/C9H18/c1-8(2)9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3.

What is the InChIKey of isopropylcyclohexane?

The InChIKey of isopropylcyclohexane is GWESVXSMPKAFAS-UHFFFAOYSA-N.

What is the canonical SMILES of isopropylcyclohexane?

The canonical SMILES of isopropylcyclohexane is CC(C)C1CCCCC1.

What is the CAS number of isopropylcyclohexane?

The CAS number of isopropylcyclohexane is 696-29-7.

What is the UNII of isopropylcyclohexane?

The UNII of isopropylcyclohexane is 5S52JAD8P7.

What is the DSSTox Substance ID of isopropylcyclohexane?

The DSSTox Substance ID of isopropylcyclohexane is DTXSID2061012.

What is the complexity of isopropylcyclohexane?

The complexity of isopropylcyclohexane is 68.1.

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