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

Benzoic acid, 2-[bis[4-(dimethylamino)phenyl]methyl]-

HCID 413005
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
62632-80-8
Standard SMILES
CN(C)c1ccc(C(c2ccc(N(C)C)cc2)c2ccccc2C(=O)O)cc1
InChIKey
ACQOEZAKAIDUJI-UHFFFAOYSA-N
Molecular formula
C24H26N2O2
Average molar mass
374.5 g/mol
Monoisotopic mass
374.19942808

Names & identifiers

Preferred name
Benzoic acid, 2-[bis[4-(dimethylamino)phenyl]methyl]-
IUPAC
2-[bis[4-(dimethylamino)phenyl]methyl]benzoic acid

Names & synonyms

62632-80-8Benzoic acid, 2-[bis[4-(dimethylamino)phenyl]methyl]-DTXSID603286712-{Bis[4-(dimethylamino)phenyl]methyl}benzoic acid

Database identifiers

CAS
62632-80-8
PubChem CID
413005
DTXSID
DTXSID60328671

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
43.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
28
Formal charge
0
Complexity
463

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes