Basic information
- CAS
161446-90-8- Standard SMILES
OCc1ccc(F)c(Cl)c1- InChIKey
KRQHBUXUXOPOON-UHFFFAOYSA-N- Molecular formula
- C7H6ClFO
- Average molar mass
- 160.57 g/mol
- Monoisotopic mass
- 160.00912071
Names & identifiers
- Preferred name
- 3-Chloro-4-fluorobenzyl alcohol
- IUPAC
- (3-chloro-4-fluorophenyl)methanol
- English name
- 3-CHLORO-4-FLUOROBENZYL ALCOHOL
- Molecular formula
- C7H6ClFO
- Molecular weight
- 160.57
Names & synonyms
3-Chloro-4-fluorobenzyl alcohol161446-90-8DTXSID50378589RefChem:278298DTXCID90329616(3-chloro-4-fluorophenyl)methanolBenzenemethanol, 3-chloro-4-fluoro-MFCD016315503-Chloro-4-fluorobenzyla alcoholBenzenemethanol,3-chloro-4-fluoro-4-fluoro-3-chlorobenzenemethanolAKOS005257763
Show more names
RARECHEM AL BD 0222(3-Chloro-4-fluorophenyl)3-Chloro-4-fluorobenzylaalcohol3-Chloro-4-fluorobenzenemethanol3-chloro-4-fluorobenzylalcohol97%3-Chloro-4-fluorobenzyl alcohol 97%(3-Chloro-4-fluorophenyl)methanol - [C89428]
PS-8773AC-26176SY032303EN300-313201(3-chloro-4-fluorophenyl)methan-1-ol3-chloro-4-fluorobenzylalcohol(3-chloro-4-fluoro-phenyl)-methanolFT-0615390
Database identifiers
- CAS
161446-90-8- PubChem CID
- 2773607
- DTXSID
DTXSID50378589- EC Number
- 642-649-8
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 110
Physicochemical properties
- Boiling point
- 243 ℃ · 243℃
- Density
- 1.344 · 1.344
- refractive index
- 1.5355 · 1.5355
- Flash point
- 100 ℃ · 100℃
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 13 · 13+-.0.10(Predicted)
- Appearance
- Colorless to light yellow Liquid
- Water Solubility
- Slightly soluble in water.
- CAS DataBase Reference
- 161446 · 161446-90-8(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 280 g-P305+P351+P338 · P280g-P305+P351+P338
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
- HazardClass
- IRRITANT
- HS Code
- 2906290090 · 2906290090
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 6 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2906290090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36/37/39
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319
- Precautionary statements
- P280g-P305+P351+P338
Chemistry & industry
Applications
Uses3-Chloro-4-fluorobenzyl alcohol is used as a pharmaceutical intermediate.
Upstream & downstream products
Upstream raw materials
Suppliers80 total
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]
江苏贵仁医药有限公司+86-13815020719 · [email protected]
合肥曼奇诺生物医药技术有限公司19719236623 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
石家庄斯迪亚诺精细化工有限公司0311-89250318 13582355795 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
黄石精驰医药有限公司17771967576; 17771967576 · [email protected]
广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海珂华生物科技有限公司021-60455363 18019463053 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
陕西麟邦实业有限公司17709134430 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
上海石洋化工有限公司021-56795766 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
天津安浩生物科技有限公司[email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
阳谷荣科商贸有限公司15863541132 · [email protected]
上海纳谦化学科技有限公司13598610367 13598610367 · [email protected]
南京多隆生物科技有限公司18905173768 · [email protected]
陕西缔都医药化工有限公司+86-29-87569262 +86-15003564040 · [email protected]
常州言己生物科技有限公司0519-83556355 18015005120 · [email protected]
北京禾兴源科技有限公司18511709189 · [email protected]
聊城莱博特生物医药科技有限公司0635-893290 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
菏泽星达医药科技有限公司13583079096 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
德州博腾精细化工有限公司[email protected]
石家庄晔晟化工科技有限公司18031147013 18031147013 · [email protected]
南京雅科伦医药科技有限公司025-66096098 3165145969 · [email protected]
上海策嵘生物科技有限公司（定制合成实验室）13062833949 · [email protected]
大连金点生物科技有限公司0411-0411-00000000 13644282108 · [email protected]
上海贤鼎生物科技有限公司021-021-52271985 17721149837 · [email protected]
上海尊理加生命科技有限公司021-34045219 13062664914 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
上海百舜生物科技有限公司021-37581181 · [email protected]
上海臻励生物科技有限公司021-16621358918; 18516310516;16621358918;13045646768 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
Related reactions
12 records
Compound notes
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