Hexane,2-phenyl-3-propyl

Hexane,2-phenyl-3-propyl
Compound Structure:
Synonyms: 3-Propylhexan-2-ylbenzene; Hexane, 2-phenyl-3-propyl-; (1-Methyl-2-propylpentyl)benzene
Compound ID: NMPC-1123
PubChem ID:

570586
Molecular Formula: C15H24
Canonical SMILES: CCCC(CCC)C(C)C1=CC=CC=C1
InChIKey: LOMGIEBMVZQYRB-UHFFFAOYSA-N
About the compound:
Properties:

Chemical and Physical Properties

Computed Properties

Property Name

Property Value

Molecular Weight

204.35 g/mol

XLogP3-AA

6

Hydrogen Bond Donor Count

0

Hydrogen Bond Acceptor Count

0

Rotatable Bond Count

6

Exact Mass

204.187800766 g/mol

Monoisotopic Mass

204.187800766 g/mol

Topological Polar Surface Area

0Ų

Heavy Atom Count

15

Formal Charge

0

Complexity

138

Isotope Atom Count

0

Defined Atom Stereocenter Count

0

Undefined Atom Stereocenter Count

1

Defined Bond Stereocenter Count

0

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Source: PubChem            
Source Species: Hippocratea indica
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