Basic information
- CAS
85345-76-2- Standard SMILES
O=C(Cl)c1cccc(Cl)c1F- InChIKey
VBYJOUAMJITBNL-UHFFFAOYSA-N- Molecular formula
- C7H3Cl2FO
- Average molar mass
- 193 g/mol
- Monoisotopic mass
- 191.9544983
Names & identifiers
- Preferred name
- 3-Chloro-2-fluorobenzoyl chloride
- IUPAC
- 3-chloro-2-fluorobenzoyl chloride
- English name
- 3-Chloro-2-fluorobenzoyl chloride
- Molecular formula
- C7H3Cl2FO
- Molecular weight
- 193
Names & synonyms
3-Chloro-2-fluorobenzoyl chloride85345-76-2DTXSID90378583RefChem:278165DTXCID30329610624-666-23-chloro-2-fluorobenzoylchloride3-chloro-2-fluoro-benzoyl chlorideMFCD016315482-FLUORO-3-CHLOROBENZOYL CHLORIDEBenzoyl chloride, 3-chloro-2-fluoro-3-chloro-2-fluoro benzoyl chloride
Show more names
SKL1241BUTTPARK 30\01-512-Fluoro-3-ChlorobenzoylChloride3-Chloro-2-fluorobenzoyl chloride 97%3-Chloro-2-fluorobenzoyl chloride, 97+%Benzoyl chloride, 3-chloro-2-fluoro- (9CI)
SCHEMBL413285SCHEMBL29454770VBYJOUAMJITBNL-UHFFFAOYSA-N2-fluoro-3-chloro-benzoyl chlorideSBB091524AKOS0062229783-Chloro-2-fluorobenzoyl chloride, 98%PS-10778
Database identifiers
- CAS
85345-76-2- PubChem CID
- 2773598
- DTXSID
DTXSID90378583- EC Number
- 624-666-2
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 163
Physicochemical properties
- Boiling point
- 202 · 202-203 °C (lit.)
- Density
- 1.451 g/mL · 1.451 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.5370(lit.)
- Flash point
- 130 °F · 130 °F
- form
- liquid
- color
- Colourless
- Sensitive
- Moisture Sensitive
- InChI
- 1S/C7H3Cl2FO/c8-5-3-1-2-4(6(5)10)7(9)11/h1-3H
- InChIKey
- VBYJOUAMJITBNL-UHFFFAOYSA-N
- SMILES
- Fc1c(Cl)cccc1C(Cl)=O
- CAS DataBase Reference
- 85345 · 85345-76-2(CAS DataBase Reference)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02,GHS05
- Signal word
- Danger
- Hazard statements
- 226 · H226-H314
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
H226 (88.6%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 44 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (88.6%)
Safety data
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- wgk
- 3
- ridadr
- UN 2920 8/PG 2
- hs_code
- 29163990
- risk_code
- 10-34
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05
- hazard_code
- C
- hazard_note
- Corrosive
- safety_code
- 26-36/37/39-45
- hazard_class
- 8
- Storage Class
- 3 - Flammable liquids
- packing_group
- II
- Hazard statements
- H226-H314
- Limited Quantities
Chemistry & industry
Suppliers72 total
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
Changzhou Anxuan Chemical Co., Ltd+86-0519-89882563 +86-18961279162 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
山东利腾生物科技有限公司+86-18663721413 +86-15552573001 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
Wuhan EnTai Technology Development Co,.Ltd86-27-82330560 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
Related reactions
7 records
Compound notes
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