Α,α,α-trifluoro-m-toluidine

1-Amino-3-(trifluoromethyl)benzene
3-(Trifluoromethyl)aniline
3-(Trifluoromethyl)benzenamine
3-(Trifluoromethyl)phenylamine
3-Amino-α,α,α-trifluorotoluene
3-Aminobenzotrifluoride
Benzenamine, 3-(trifluoromethyl)-
m-(Trifluoromethyl)aniline
m-Amino-α,α,α-trifluorotoluene
m-Aminobenzal fluoride
m-Aminobenzotrifluoride
m-Toluidine, α,α,α-trifluoro-
m-Trifluoromethylaniline

Property	Value
InChI2D key string chemrof:inchi2d_key_string	VIUDTWATMPPKEL-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C7H6F3N/c8-7(9,10)5-2-1-3-6(11)4-5/h1-4H,11H2
IUPAC name chemrof:IUPAC_name	1-Amino-3-(trifluoromethyl)benzene
Molecular formula chemrof:molecular_formula	C7H6F3N
Molecular mass chemrof:molecular_mass	161.126
Monoisotopic mass chemrof:monoisotopic_mass	161.045234
SMILES string chemrof:smiles_string	Nc1cccc(C(F)(F)F)c1

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=98-16-8	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.002.404	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID9024512	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=4540	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1162293	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/Z1RWM538YN	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J54.405A	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/7375	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/erg/#2948	enrich_references.pubchem_identifier_url
Wikidata	https://www.wikidata.org/wiki/Q424934	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/3-(Trifluoromethyl)aniline	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
289f009c-7e6b-4115-baa1-a7d2c2db9e3f	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
d7f604e9-abc0-475c-bd46-5fcc7da84143	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
ff8775df-27ea-4e1d-8c79-be7499b7fa47	Environmental → Air → Indoor	EF 3.1	kg	2
47e39359-2a41-4eaf-a9a8-346951eca275	Environmental → Air → Long-term	EF 3.1	kg	0
47ad5f1b-b611-49e1-be6c-4883b24aa062	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
3a952acc-8a34-472e-ad8e-0055cf889bd2	Environmental → Air → Unknown	EF 3.1	kg	2
f1d0514a-49df-4dbd-aeef-894c1bee2505	Environmental → Ground → Agricultural	EF 3.1	kg	2
4680e388-55b7-4926-b315-3bf47e3274a0	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
eb851977-a804-4809-9c51-f2696e278d98	Environmental → Ground → Unknown	EF 3.1	kg	2
452b5fea-3ef0-4412-b50c-75b074338663	Environmental → Water → Long-term	EF 3.1	kg	0
05465f0f-01e5-4302-9fb8-4de723fa6f44	Environmental → Water → Ocean	EF 3.1	kg	2
b0075093-a4f9-471f-aae1-22176195a3f6	Environmental → Water → Surface water	EF 3.1	kg	2
d6b25c86-334f-428e-aee9-d5bb9239bd2f	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (56 changes)

Open the changes page

Flow object JSON

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      "reason": "",
      "types": [
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      ],
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:wasDerivedFrom": "semantic_typing.rule.neutral_molecule"
      }
    }
  },
  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "98-16-8"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=98-16-8"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
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        }
      ],
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
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      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "202-643-4"
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      "rdfs:seeAlso": [
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      ],
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
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  ]
}

You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works

Α,α,α-trifluoro-m-toluidine

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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