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

11-Bromoundecyl methacrylate

HCID 193702
New noteNew reactionRequest quotesPrint preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
33795-49-2
Standard SMILES
C=C(C)C(=O)OCCCCCCCCCCCBr
InChIKey
MBGPMDXXPUWUIJ-UHFFFAOYSA-N
Molecular formula
C15H27BrO2
Average molar mass
319.28 g/mol
Monoisotopic mass
318.11944

Names & identifiers

Preferred name
11-Bromoundecyl methacrylate
IUPAC
11-bromoundecyl 2-methylprop-2-enoate
English name
11-bromoundecyl methacrylate
Molecular formula
C15H27BrO2
Molecular weight
319.28

Names & synonyms

11-Bromoundecyl methacrylate33795-49-211-bromoundecylmethacrylate11-Bromoundecyl-methacrylate11-BrumcDTXSID501874562-Propenoic acid, 2-methyl-, 11-bromoundecyl esterRefChem:77791DTXCID6010994711-bromoundecyl 2-methylprop-2-enoate11-bromoundecyl methylacrylateSCHEMBL2397960
Show more names
11-bromoundecyl2-methylprop-2-enoate
MBGPMDXXPUWUIJ-UHFFFAOYSA-NMFCD22495088AKOS0252951752-methylacrylic acid 11-bromoundecyl esterDB-363192

Database identifiers

CAS
33795-49-2
PubChem CID
193702
DTXSID
DTXSID50187456
Nikkaji
J1.152.332C

Properties

Computed structural properties

XLogP
6.5
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
13
Heavy atoms
18
Formal charge
0
Complexity
227

Physicochemical properties

Boiling point
360.3 · 360.3±15.0 °C(Predicted)
Density
1.109 · 1.109±0.06 g/cm3(Predicted)

Suppliers

Loading…

Open inquiries

Loading…

Related reactions

5 records
New reaction record
HRID 302917 reaction equation
HRID 302917As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 479924 reaction equation
HRID 479924As productuspto-grants-2003_11
HRID 1408264 reaction equation
HRID 1408264As reactantuspto-grants-2014_12
HRID 1756486 reaction equation
HRID 1756486As productuspto-grants-1995_08
HRID 2308112 reaction equation
HRID 2308112As productuspto-grants-2004_12

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes