HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.9
  1. Home
  2. /Compound

6-Methyl-1,5-heptadiene

HCID 138971
New noteNew reactionRequest quotesPrint preview
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
7270-50-0
Standard SMILES
C=CCCC=C(C)C
InChIKey
KUFDSEQTHICIIF-UHFFFAOYSA-N
Molecular formula
C8H14
Average molar mass
110.2 g/mol
Monoisotopic mass
110.10955045

Names & identifiers

Preferred name
6-Methyl-1,5-heptadiene
IUPAC
6-methylhepta-1,5-diene
English name
6-Methyl-1,5-heptadiene
Molecular formula
C8H14
Molecular weight
110.2

Names & synonyms

6-Methyl-1,5-heptadiene7270-50-0DTXSID30223003RefChem:104977DTXCID90145494KUFDSEQTHICIIF-UHFFFAOYSA-N6-methylhepta-1,5-dieneSODIUM BO-PROPOXIDE6-methyl-hepta-1,5-dieneSCHEMBL43185SCHEMBL6131066SCHEMBL6283056
Show more names
2-methyl-2,6-heptadiene
SCHEMBL6907916SCHEMBL7802696AKOS006275104DB-055667

Database identifiers

CAS
7270-50-0
PubChem CID
138971
DTXSID
DTXSID30223003
Nikkaji
J503.749B

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
3
Heavy atoms
8
Formal charge
0
Complexity
84.2

Experimental & physicochemical properties

SpringerMaterials PropertiesDensity

Chemistry & industry

Upstream & downstream products

Downstream products

2-Methyl-2-heptene

Suppliers

Loading…

Open inquiries

Loading…

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes