# 墨绿色 (CAS 59129-79-2)

CAS: 59129-79-2
PubChem CID: 100964
InChIKey: IXHBSOXJLNEOPY-UHFFFAOYSA-N
Molecular formula: C36H30N2O3
Molar mass: 538.6 g/mol
IUPAC: 2'-anilino-6'-(N-ethyl-4-methylanilino)-3'-methylspiro[2-benzofuran-3,9'-xanthene]-1-one
SMILES: CCN(C1=CC=C(C=C1)C)C2=CC3=C(C=C2)C4(C5=CC=CC=C5C(=O)O4)C6=C(O3)C=C(C(=C6)NC7=CC=CC=C7)C
InChI: InChI=1S/C36H30N2O3/c1-4-38(26-16-14-23(2)15-17-26)27-18-19-30-34(21-27)40-33-20-24(3)32(37-25-10-6-5-7-11-25)22-31(33)36(30)29-13-9-8-12-28(29)35(39)41-36/h5-22,37H,4H2,1-3H3
logP (XLogP3): 8.5
PSA: 50.8 A^2
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 5
Heavy atoms: 41
3D structure: 71 atoms, 77 bonds

## About the compound

墨绿色 (CAS 59129-79-2) is a chemical compound registered under CAS number 59129-79-2. Molecular formula: C36H30N2O3. Molar mass: 538.6 g/mol. The full systematic IUPAC name is: 2'-anilino-6'-(N-ethyl-4-methylanilino)-3'-methylspiro[2-benzofuran-3,9'-xanthene]-1-one. The molecule contains 71 atoms connected by 77 chemical bonds. 
Chemical data comes from the PubChem (NIH), ChEMBL (EBI) and NIST WebBook databases. GHS statement translations comply with the CLP Regulation (EC 1272/2008). Interactive 3D model and 2D skeleton available at: https://molgod.org/molekula/59129-79-2/


## Synonyms

  - 2'-anilino-6'-[ethyl(p-tolyl)amino]-3'-methylspiro[isobenzofuran-1(3H),9'-[9H]xanthene]-3-one
  - EINECS 261-618-6
  - 3-(N-Ethyl-N-p-tolyl)amino-6-methyl-7-anilinofluoran
  - 3'-(N-Ethyl-N-p-tolylamino)-6'-methyl-7'-anilinofluoran
  - 2'-Anilino-6'-(ethyl(p-tolyl)amino)-3'-methylspiro(isobenzofuran-1(3H),9'-(9H)xanthene)-3-one
  - RefChem:888791
  - DTXCID301025684
  - 261-618-6
  - 59129-79-2
  - C36H30N2O3
  - MFCD27977254
  - 2'-anilino-6'-(N-ethyl-4-methylanilino)-3'-methylspiro[2-benzofuran-3,9'-xanthene]-1-one

## Available in the shop

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Product: 墨绿色 (CAS 59129-79-2) — Shenyang Photosensitive Research Institute
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## Data sources

  - PubChem CID 100964: https://pubchem.ncbi.nlm.nih.gov/compound/100964
  - NIST WebBook: https://webbook.nist.gov/cgi/cbook.cgi?ID=59129-79-2
  - ChEMBL: https://www.ebi.ac.uk/chembl/g/#search_results/all/query=59129-79-2

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Last updated: 2026-09-02
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