1H-indole
Facts
20 properties- Instance of
- type of chemical entity
- Subclass of
- indole alkaloid, indole[4][5]
- Part of
- tryptophanase activity, indole-3-glycerol-phosphate lyase activity, indole-2-monooxygenase activity, indole 2,3-dioxygenase activity, L-serine hydro-lyase (adding indole, L-tryptophan-forming) activity[6][7][8][9][10]
- Boiling point
- +254
- Canonical SMILES
- C1=CC=C2C(=C1)C=CN2[2]
- Chemical formula
- C₈H₇N[3]
- Density
- +1.22
- Described by source
- Otto's encyclopedia, Encyclopædia Britannica 11th edition, Armenian Soviet Encyclopedia, vol. 4
- Different from
- indene
- Found in taxon
- Jasminum grandiflorum, Zingiber mioga, Narcissus tazetta, maize, Daphne odora, northern giraffe, Gossypium hirsutum, Ficus carica, Amorphophallus eichleri, yerba mate, Isatis tinctoria, Sauromatum venosum, Polygala senega, liquorice, Hordeum vulgare, Tanacetum parthenium, Senecio viscosissimus, Senecio adenotrichius, Lepidium meyenii, Scutellaria baicalensis, Nothomyrmecia macrops, Cucurbita maxima, Brassica napus, Brassica campestris, Brassica juncea, Brassica nigra, Sinapis alba, Coprinopsis picacea, Lonicera japonica, Citrus hystrix, Citrus reticulata, Psydrax subcordatus, Tecoma stans, Escherichia coli, Paenibacillus polymyxa, Salvia divinorum, Vibrio parahaemolyticus, Alliaria petiolata, Agave amica, kumquat, Citrus × paradisi, Tetrastigma hemsleyanum, Caenorhabditis elegans, Arabidopsis thaliana, Medicago sativa, Nicotiana tabacum, Citrus × deliciosa, Brassica rapa, Lucensosergia lucens, Prunus padus, Bulbophyllum variegatum[14][15][16][17][18][19][20][21][22][23][24]
- Mass
- +117.058
- Melting point
- +52.0, +52.3
- PKa
- +17, +16.2
- Partition coefficient water/octanol
- +2.14
- Solubility
- +1.87
- Subject has role
- primary metabolite
- Substrate of
- tryptophan synthase
- Tautomer of
- 3H-indole
- Vapor pressure
- +100
- Brockhaus Enzyklopädie online ID
- indol
- CAS Registry Number
- 120-72-9
- Cannabis Database ID
- 004861
- ChEBI ID
- 16881
- ChEMBL ID
- CHEMBL15844
- ChemSpider ID
- 776
- CosIng number
- 40299
- DSSTOX compound identifier
- DTXCID40737
- DSSTox substance ID
- DTXSID0020737
- De Agostini ID
- indòlo
- DrugBank ID
- DB04532
- EC number
- 204-420-7
Show all 52 identifiers +40
- ECHA Substance Infocard ID
- 100.004.019
- Encyclopædia Britannica Online ID
- science/indole
- FL number
- 14.007
- Freebase ID
- /m/02dpgh
- Gmelin number
- 3477
- Gran Enciclopèdia Catalana ID
- indole
- Gran Enciclopèdia Catalana ID (former scheme)
- 0116392
- Great Russian Encyclopedia Online ID (2017)
- 2010191
- Great Russian Encyclopedia portal ID
- indol-209399
- HSDB ID
- 599
- Human Metabolome Database ID
- HMDB0000738
- InChIKey
- SIKJAQJRHWYJAI-UHFFFAOYSA-N
- JECFA number
- 1301
- JSTOR topic ID (archived)
- indoles
- KEGG ID
- C00463
- KNApSAcK ID
- C00001418
- Lex ID
- indol
- MassBank accession ID
- MSBNK-Fac_Eng_Univ_Tokyo-JP002009, MSBNK-Fac_Eng_Univ_Tokyo-JP002807, MSBNK-Fac_Eng_Univ_Tokyo-JP003524, MSBNK-RIKEN-PR100053
- NDL Authority ID
- 00564100
- NE.se ID
- indol
- NMRShiftDB structure ID
- 10006007
- NSC number
- 1964
- Natural Product Atlas ID
- NPA011269
- PDB ligand ID
- IND
- PesticideInfo chemical ID
- PRI3651
- Probes And Drugs ID
- PD014419
- Proleksis enciklopedija ID
- 27933
- PubChem CID
- 798
- Quora topic ID
- Indole
- RTECS number
- NL2450000
- Reaxys registry number
- 107693
- RxNorm CUI
- 1311224
- Römpp online ID
- RD-09-00529
- SPLASH
- splash10-014i-9800000000-4160749bd673d5e00048, splash10-014i-9800000000-33bf321019a6a8e3401a, splash10-014i-0900000000-e6b11e225744a0d85f71, splash10-014i-0900000000-7b49c1c370d7355c5e6f, splash10-0006-9000000000-050ef45f3ec404d7eb65, splash10-0006-9000000000-79ff95be504a5efad264, splash10-0006-9000000000-31ff8b484e0dc207fcc9, splash10-0006-9000000000-864a48552fea562fc370, splash10-014i-0900000000-bd82bfab4567619b5c41, splash10-014i-0900000000-6bff353534e6f5f9105b, splash10-014i-0900000000-c4e339d4a1d3fda0a949, splash10-014i-2900000000-100cd0cc67ac9eda3f4e, splash10-014l-5900000000-79447b563349d08aacc0, splash10-00kf-9800000000-a1ce5da5416e6d003ff9, splash10-00kf-9500000000-1dcc90ff56b80930d454, splash10-00kf-9300000000-70e7382a85a822aac101, splash10-00kf-9200000000-25d55adc1c615e7d016f, splash10-014i-0900000000-ddb36a6cce4f103bc423, splash10-014i-0900000000-1d2ff7e56486b9ca4c2d, splash10-014i-0900000000-71de1f813c37f2549be4, splash10-014i-1900000000-ffbab8ee8d6ea10f6b88, splash10-014l-4900000000-75a01f786adcdfc0442d, splash10-00kf-9800000000-310aef0907982c2885d7, splash10-00kf-9500000000-5aaacb46312595a18847, splash10-0006-9300000000-b54d08abed2c79be3a55, splash10-00kf-9100000000-5897e1655f1aa0e2191e, splash10-014i-0900000000-ddac2994fff8f21fe8dd, splash10-014i-0900000000-2c0f27b62f220e2ee3a6, splash10-014i-0900000000-53afbaab2e64087b986b, splash10-014i-2900000000-ccfd9273f820030931d2, splash10-014l-6900000000-be79f1ccf8a16cf5fb22, splash10-014u-9500000000-1a5110633cd682046296, splash10-000l-9100000000-889e7648dad637476da4, splash10-000i-9000000000-38d6c79fed7b04d321d5, splash10-0006-9100000000-2531cceca05522a5489e, splash10-014l-9000000000-5e07c15293929ff4440f, splash10-014i-0900000000-622dfed80152ea08d52a, splash10-014i-9700000000-3b1ec48b5bce79adb282
- SureChEMBL ID
- 698
- UNII
- 8724FJW4M5
- UniChem compound ID
- 634877
- ZVG number
- 31030
From open datasets, joined by identifier and shown only for properties Wikidata does not state on this entity — except where the dataset is the registry authority for the fact (ClinicalTrials.gov on trial registration data): there its value is shown instead, with Wikidata's noted beside it. Every row carries its dataset edition and licence.
where from?
- Source
- ndl_authorities
- Edition
- 20261001 · as of 2026-10-01 · newer edition 20261103 landed
- Licence
- pdl-1.0
- Credit
- data obtained from Web NDL Authorities (National Diet Library)
- Bronze
- manifest sha256
6e048898660f1188… - Transform
- 4ort-mint · lake · version not recorded
Found in taxon 48
Described by source 1
Different from 1
Subclass of 1
Subject has role 1
0 sources
Summary
1H-indole is a type of chemical entity[1].