HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

Methyl (alphaE)-4-methoxy-alpha-((4-methoxyphenyl)methylene)benzeneacetate

HCID 816788
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
50415-62-8
Standard SMILES
COC(=O)/C(=C/c1ccc(OC)cc1)c1ccc(OC)cc1
InChIKey
NZGLISDZKOQGNP-SFQUDFHCSA-N
Molecular formula
C18H18O4
Average molar mass
298.3 g/mol
Monoisotopic mass
298.12050905

Names & identifiers

Preferred name
Methyl (alphaE)-4-methoxy-alpha-((4-methoxyphenyl)methylene)benzeneacetate
IUPAC
methyl (E)-2,3-bis(4-methoxyphenyl)prop-2-enoate

Names & synonyms

50415-62-8Methyl (alphaE)-4-methoxy-alpha-((4-methoxyphenyl)methylene)benzeneacetateMethyl (alphaE)-4-methoxy-alpha-[(4-methoxyphenyl)methylene]benzeneacetateRefChem:353127CHEMBL78486(E)-2,3-Bis-(4-methoxy-phenyl)-acrylic acid methyl esterDTXSID401163772BDBM50145701methyl (2e)-2,3-bis(4-methoxyphenyl)acrylateMethyl (2E)-2,3-bis(4-methoxyphenyl)prop-2-enoateMethyl (I+/-E)-4-methoxy-I+/--[(4-methoxyphenyl)methylene]benzeneacetate

Database identifiers

CAS
50415-62-8
PubChem CID
816788
DTXSID
DTXSID401163772
ChEMBL
CHEMBL78486

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
44.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
22
Formal charge
0
Complexity
375

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes