HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

Dodecane, 6,7-dimethyl

HCID 529936
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
20904-59-0
Standard SMILES
CCCCCC(C)C(C)CCCCC
InChIKey
VMMASAYFMGOBIS-UHFFFAOYSA-N
Molecular formula
C14H30
Average molar mass
198.39 g/mol
Monoisotopic mass
198.23475096

Names & identifiers

Preferred name
Dodecane, 6,7-dimethyl
IUPAC
6,7-dimethyldodecane

Names & synonyms

Dodecane, 6,7-dimethyl6,7-dimethyldodecane20904-59-0SCHEMBL8949780SCHEMBL13858888DTXSID70336207

Database identifiers

CAS
20904-59-0
PubChem CID
529936
DTXSID
DTXSID70336207

Properties

Computed structural properties

XLogP
7.2
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
9
Heavy atoms
14
Formal charge
0
Complexity
92.6

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes