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

N-Methyl-2-vinylaniline

HCID 220587
New noteNew reactionRequest quotesPrint preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
5339-28-6
Standard SMILES
C=Cc1ccccc1NC
InChIKey
PUQNLIKQRSZTTM-UHFFFAOYSA-N
Molecular formula
C9H11N
Average molar mass
133.19 g/mol
Monoisotopic mass
133.08914936

Names & identifiers

Preferred name
N-Methyl-2-vinylaniline
IUPAC
2-ethenyl-N-methylaniline

Names & synonyms

N-Methyl-2-vinylaniline5339-28-62-ethenyl-n-methylanilineNSC3495SCHEMBL1770005DTXSID30968043NSC-3495AKOS006349330

Database identifiers

CAS
5339-28-6
PubChem CID
220587
DTXSID
DTXSID30968043

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
12 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
10
Formal charge
0
Complexity
109

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 & identifiersPropertiesRelated reactionsCompound notes