1-chloro-4-(chloromethyl)benzene
fo-a15965c80ce0c783
Identity
- Type
- Neutral molecule
- CAS
- 104-83-6
- EC
- 203-242-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
12- (4-Chlorophenyl)methyl chloride
- 1-(Chloromethyl)-4-chlorobenzene
- 4-Chloro-1-(chloromethyl)benzene
- 4-Chlorobenzyl chloride
- 4-Chloromethylchlorobenzene
- Benzene, 1-chloro-4-(chloromethyl)-
- p,α-Dichlorotoluene
- p-Chlorobenzyl chloride
- p-Chlorophenylmethyl chloride
- Toluene, p,α-dichloro-
- α,4-Dichlorotoluene
- α,p-Dichlorotoluene
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | JQZAEUFPPSRDOP-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C7H6Cl2/c8-5-6-1-3-7(9)4-2-6/h1-4H,5H2 |
| IUPAC name chemrof:IUPAC_name | 1-chloro-4-(chloromethyl)benzene |
| Molecular formula chemrof:molecular_formula | C7H6Cl2 |
| Molecular mass chemrof:molecular_mass | 161.031 |
| Monoisotopic mass chemrof:monoisotopic_mass | 159.984656 |
| SMILES string chemrof:smiles_string | ClCc1ccc(Cl)cc1 |
Known URLs
8Where 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=104-83-6 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.002.948 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID4051530 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=34032 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/Q9HS4N7D3M | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.035K | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/7723 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q17521020 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 53acfedf-80bf-4b38-b3a0-ffc21d505749 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 9c71c0d5-4896-4a23-88ef-a5a9cc2208e6 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| ea713300-93ff-4c66-970c-085a868ac733 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 5206bfd8-02d4-4a06-a9dd-16a961280a98 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| b6c52420-708e-4d22-b27f-39f38c2f5cb7 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 312f09a3-8874-4267-9a56-e0ff150e005e | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| e8875e54-9bb9-4273-93af-7f372d4b6ddb | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| e40310d8-a5fd-44d9-bd78-3e3ba9afc2d7 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| adae8761-0c8d-402e-97c2-dcb22dc197f3 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 35c10ce0-f914-4707-a8eb-fc3d5a5dbcaa | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 0f20f0a7-8c60-431b-8cbf-f3c5ed0fda41 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| e33b2ccf-9b63-4325-abbb-191158884ec6 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 36301062-3800-4011-9198-739c8ab7e31c | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (54 changes)
Full record
Flow object JSON
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Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
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