Consensus flow list

Identity

Type
Neutral molecule
CAS
10081-67-1
EC
233-215-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 4-(1-methyl-1-phenylethyl)-n-[4-(1-methyl-1-phenylethyl)phenyl]aniline

Alternative labels

28

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string UJAWGGOCYUPCPS-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C30H31N/c1-29(2,23-11-7-5-8-12-23)25-15-19-27(20-16-25)31-28-21-17-26(18-22-28)30(3,4)24-13-9-6-10-14-24/h5-22,31H,1-4H3
IUPAC name chemrof:IUPAC_name 4-(1-Methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]benzenamine
Molecular formula chemrof:molecular_formula C30H31N
Molecular mass chemrof:molecular_mass 405.585
Monoisotopic mass chemrof:monoisotopic_mass 405.24565
SMILES string chemrof:smiles_string CC(C)(c1ccccc1)c1ccc(Nc2ccc(C(C)(C)c3ccccc3)cc2)cc1

Known URLs

8

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=10081-67-1 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.030.182 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0027721 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3184368 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/4Y29EDV7KQ enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J39.716D enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/82343 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q72446800 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
9cade67b-be5e-4792-8c4d-28b460735124 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
02c93510-82d5-4d87-b0ba-cb54fbf026dd Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
86bb4105-f9bd-4780-b90c-ea6d9c4a4b0e Environmental → Air → Indoor EF 3.1 kg 2
441c7cfe-ff6e-4d06-ae9a-a28d69c77e44 Environmental → Air → Long-term EF 3.1 kg 0
a2b5bacf-689c-457b-8cec-83401112c633 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
6bac3a50-898a-47b9-9224-8984b6e2982e Environmental → Air → Unknown EF 3.1 kg 2
ae953a67-1b23-40ae-8a22-d80f5e187dba Environmental → Ground → Agricultural EF 3.1 kg 2
7bd75c0f-4353-465a-9834-76881f9df44c Environmental → Ground → Non-agricultural EF 3.1 kg 2
7c470be5-1517-4532-88c8-c40352ce7a4f Environmental → Ground → Unknown EF 3.1 kg 2
186243da-65ba-469a-b4f6-a258e22a1d9f Environmental → Water → Long-term EF 3.1 kg 0
378ffc23-54d9-471b-8a5d-3e4fa82c4de4 Environmental → Water → Ocean EF 3.1 kg 2
eb609bb8-ba2f-4ba8-87a8-4af9e5ab374d Environmental → Water → Surface water EF 3.1 kg 2
1f74a669-7849-498c-b08a-7ee483d3a4e4 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-c1ebad9c3f8efc83",
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    {
      "@value": "4-(1-methyl-1-phenylethyl)-n-[4-(1-methyl-1-phenylethyl)phenyl]aniline",
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  ],
  "altLabel": [
    {
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    {
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      "@value": "Nonflex DCD",
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      "@value": "Permanax 49",
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      "@value": "Vanox CDPA",
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      "@value": "Yapox RA 103",
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  ],
  "properties": {
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