CID 21512609
PubChem CID
21512609
Structure
Molecular Formula
Status
Non-live
Molecular Weight
212.41 g/mol
Dates
- Create:2007-12-05
Chemical Structure Depiction
5-methyl-4,4-dipropyloctane
InChI=1S/C15H32/c1-6-10-14(5)15(11-7-2,12-8-3)13-9-4/h14H,6-13H2,1-5H3
AXIXYZJGCNRXAQ-UHFFFAOYSA-N
CCCC(C)C(CCC)(CCC)CCC
C15H32
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
212.41 g/mol
Property Name
XLogP3-AA
Property Value
7.6
Property Name
Hydrogen Bond Donor Count
Property Value
0
Property Name
Hydrogen Bond Acceptor Count
Property Value
0
Property Name
Rotatable Bond Count
Property Value
9
Property Name
Exact Mass
Property Value
212.250401021 g/mol
Property Name
Monoisotopic Mass
Property Value
212.250401021 g/mol
Property Name
Topological Polar Surface Area
Property Value
0 A^2
Property Name
Heavy Atom Count
Property Value
15
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
120
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
0
Property Name
Undefined Atom Stereocenter Count
Property Value
1
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
1
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
Old substance
Old substance
CONTENTS