1-chloro-4-(dichloromethyl)benzene
fo-a727d1f3ecb50630
Identity
- Type
- Neutral molecule
- CAS
- 13940-94-8
- EC
- 237-721-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
11- 4-Chloro-1-(dichloromethyl)benzene
- 4-Chlorobenzal chloride
- 4-Chlorobenzylidene chloride
- Benzene, 1-chloro-4-(dichloromethyl)-
- Dichloro(4-chlorophenyl)methane
- p-(Dichloromethyl)benzyl chloride
- p-Chlorobenzal chloride
- p-Chlorobenzylidene chloride
- Toluene, p,α,α-trichloro-
- α,α,4-Trichlorotoluene
- α,α,p-Trichlorotoluene
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | VWHNJDGWDOQJRM-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C7H5Cl3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,7H |
| IUPAC name chemrof:IUPAC_name | 1-chloro-4-(dichloromethyl)benzene |
| Molecular formula chemrof:molecular_formula | C7H5Cl3 |
| Molecular mass chemrof:molecular_mass | 195.476 |
| Monoisotopic mass chemrof:monoisotopic_mass | 193.945683 |
| SMILES string chemrof:smiles_string | Clc1ccc(C(Cl)Cl)cc1 |
Known URLs
7Where 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=13940-94-8 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.034.278 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID1065683 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/W8BC83S7JK | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J91.332D | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/84110 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q72518234 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| cc267170-60f0-48b5-b415-01945c631343 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| f04e8549-0970-49be-abbb-28f6c489e98c | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 9a6a3600-3799-46fb-b813-dcd6e895a712 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 350c6e53-49f1-43cc-a399-45153cd3d912 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 2e500f7b-27fe-40f5-bfa7-d121afb943fc | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| deb08df3-32e5-4b6a-9a1d-6df13798d60a | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| e2cafdd4-2509-44e6-9cd1-7a4040622f2e | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| f70b0b17-fa45-42ab-8cda-37ab893a19de | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| fae5853f-3533-4b9e-b518-a02f124b96f2 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 5f06c863-5ceb-4c54-b84a-3634e8bda1cd | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 34c50580-10e6-4848-9edb-f4cc912ad951 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| c9c27f5e-27b8-4718-9f32-75edc4a5f17b | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 1986feee-9851-48fb-89d8-d1c11363491a | 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