Basic information
- CAS
34743-88-9- Standard SMILES
OCCOc1ccc(Br)cc1- InChIKey
QYIOGYCRGNHDNK-UHFFFAOYSA-N- Molecular formula
- C8H9BrO2
- Average molar mass
- 217.06 g/mol
- Monoisotopic mass
- 215.97859163
Names & identifiers
- Preferred name
- 2-(p-Bromophenoxy)ethanol
- IUPAC
- 2-(4-bromophenoxy)ethanol
- English name
- 2-(4-Bromophenoxy)ethanol
- Molecular formula
- C8H9BrO2
- Molecular weight
- 217.06
Names & synonyms
2-(4-Bromophenoxy)ethanol34743-88-92-(p-Bromophenoxy)ethanolEthanol, 2-(4-bromophenoxy)-2-(4'-Bromophenoxy)ethanol.beta.-(p-Bromophenoxy)ethanolEINECS 252-181-2DTXSID80188299NSC 190715RefChem:84846beta-(p-Bromophenoxy)ethanolDTXCID60110790
Show more names
4-(2-Hydroxyethoxy)-1-bromobenzeneEthyleneGlycolMono(4-bromophenyl)Ether>2-(4-Bromophenoxy)ethanol , 2-(4-Bromophenoxy)ethanol
252-181-2QYIOGYCRGNHDNK-UHFFFAOYSA-N2-(4-bromophenoxy)ethan-1-ol2-(4-bromophenoxy)-ethanolMFCD00002860Ethylene Glycol Mono(4-bromophenyl) EtherNSC-1907151-bromo-4-(2-hydroxyethoxy)benzene
Database identifiers
- CAS
34743-88-9- PubChem CID
- 99168
- DTXSID
DTXSID80188299- UNII
- KD2YCE83WU
- EC Number
- 252-181-2
- Nikkaji
- J236.365H
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 100
Physicochemical properties
- Melting point
- 53 · 53-55 °C (lit.)
- Boiling point
- 184 °C/20 · 184 °C/20 mmHg (lit.)
- Density
- 1.4816 · 1.4816 (rough estimate)
- refractive index
- 1.493 · 1.4930 (estimate)
- Flash point
- 230 °F · >230 °F
- storage temp.
- Room temperature.
- pka
- 14.18 · 14.18±0.10(Predicted)
- form
- powder to crystal
- color
- White to Almost white
- InChI
- 1S/C8H9BrO2/c9-7-1-3-8(4-2-7)11-6-5-10/h1-4,10H,5-6H2
- InChIKey
- QYIOGYCRGNHDNK-UHFFFAOYSA-N
- SMILES
- OCCOc1ccc(Br)cc1
- CAS DataBase Reference
- 34743 · 34743-88-9(CAS DataBase Reference)
- FDA UNII
- 2 YCE83WU · KD2YCE83WU
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- hs_code
- 2909.49.1500
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302
- Hazard Classifications
- Acute Tox. 4 Oral
- Precautionary statements
- P264-P270-P301+P312+P330-P501
Chemistry & industry
Applications
Uses2-(4-Bromophenoxy)ethanol was used in the synthesis of lithium 2-(4-lithiophenoxy)ethoxide.
Upstream & downstream products
Downstream products
Suppliers81 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
山东利腾生物科技有限公司+86-18663721413 +86-15552573001 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）
Related reactions
49 records
Compound notes
Loading…