Basic information
- CAS
4885-03-4- Standard SMILES
ClC(Cl)(Oc1ccccc1)Oc1ccccc1- InChIKey
TVIUSKXXXZSVJU-UHFFFAOYSA-N- Molecular formula
- C13H10Cl2O2
- Average molar mass
- 269.12 g/mol
- Monoisotopic mass
- 268.0057849
Names & identifiers
- Preferred name
- Dichlorodiphenoxymethane
- IUPAC
- [dichloro(phenoxy)methoxy]benzene
- English name
- Dichlorodiphenoxymethane
- Molecular formula
- C13H10Cl2O2
- Molecular weight
- 269.12
Names & synonyms
Dichlorodiphenoxymethane4885-03-4DTXSID80408505RefChem:133061DTXCID90359357628-047-8[dichloro(phenoxy)methoxy]benzeneMFCD00087870diphenoxydichloromethanePhosgene diphenyl acetalBenzene, 1,1'-[(dichloromethylene)bis(oxy)]bis-SCHEMBL2743975
Show more names
TVIUSKXXXZSVJU-UHFFFAOYSA-N1,1-dichloro-1,1-diphenoxymethaneAKOS024319289SY0154461,1'-[(Dichloromethylene)bis(oxy)]dibenzeneW10367F505390
Database identifiers
- CAS
4885-03-4- PubChem CID
- 5116898
- DTXSID
DTXSID80408505- EC Number
- 628-047-8
- Nikkaji
- J282.766B
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 199
Physicochemical properties
- Melting point
- 39 · 39-44 °C (lit.)
- Boiling point
- 183 · 183-185 °C(Press: 12 Torr)
- Density
- 1.315 · 1.315±0.06 g/cm3(Predicted)
- Flash point
- 230 °F · >230 °F
- InChI
- 1S/C13H10Cl2O2/c14-13(15,16-11-7-3-1-4-8-11)17-12-9-5-2-6-10-12/h1-10H
- InChIKey
- TVIUSKXXXZSVJU-UHFFFAOYSA-N
- SMILES
- ClC(Cl)(Oc1ccccc1)Oc2ccccc2
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 260 · P260-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363
- PPE
- 3 · Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
- Hazard Codes
- C
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Corr. 1B (100%)
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
- wgk
- 3
- ridadr
- UN 1759 8/PG 2
- risk_code
- 34
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- C
- safety_code
- 26-36/37/39-45
- Storage Class
- 8A - Combustible corrosive hazardous materials
- Hazard statements
- H314
- Hazard Classifications
- Skin Corr. 1B
- Precautionary statements
- P260-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363
Chemistry & industry
Applications
UsesReactant for:Cyclocondensation of aminophenols and aminesPreparation of LIM-Kinase 2 inhibitors for the treatment of ocular hypertension
Upstream & downstream products
Downstream products
Suppliers16 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
郑州研德生物科技有限公司0371-63682289 15538176268 · [email protected]
成都思天德生物科技有限公司028-83243028 19136088901 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
郑州康弗辰医药科技有限公司18210788515; 18210788515 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
成都叮当时代医药科技有限公司028-86040038 · [email protected]
Related reactions
7 records
Compound notes
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