3-methylundecanol

3-methylundecanol
Compound Structure:
Synonyms: 3-methyl-1-undecanol;3-Methylundecanol;3-methyl-undecan-1-ol
Compound ID: NMPC-369
PubChem ID:

11041471
Molecular Formula: C12H26O
Canonical SMILES: CCCCCCCCC(C)CCO
InChIKey: CTVPPKBJEDDIHQ-UHFFFAOYSA-N
About the compound:
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

186.33 g/mol

XLogP3-AA

5

Hydrogen Bond Donor Count

1

Hydrogen Bond Acceptor Count

1

Rotatable Bond Count

9

Exact Mass

186.198365449 g/mol

Monoisotopic Mass

186.198365449 g/mol

Topological Polar Surface Area

20.2Ų

Heavy Atom Count

13

Formal Charge

0

Complexity

91.1

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: Tecoma stans
Download SDF