Basic information
- CAS
587-79-1- Standard SMILES
Fc1ccc(Cc2ccccc2)cc1- InChIKey
ADCBAIUWZPOIMC-UHFFFAOYSA-N- Molecular formula
- C13H11F
- Average molar mass
- 186.22 g/mol
- Monoisotopic mass
- 186.08447851
Names & identifiers
- Preferred name
- 4-Fluorodiphenylmethane
- IUPAC
- 1-benzyl-4-fluorobenzene
- English name
- 4-Fluorodiphenylmethane
- Molecular formula
- C13H11F
- Molecular weight
- 186.22
Names & synonyms
4-Fluorodiphenylmethane587-79-1DTXSID20345405RefChem:292912DTXCID70296478ADCBAIUWZPOIMC-UHFFFAOYSA-N1-Benzyl-4-fluorobenzeneMFCD004643291-fluoro-4-(phenylmethyl)benzeneSCHEMBL576416AKOS006228401CS-0313968
Show more names
4-Fluorodiphenylmethane>4-Fluorodiphenylmethane99%4-Fluorodiphenylmethane 99%Benzene, 1-fluoro-4-(phenylmethyl)-4-FluorodiphenylmethaneDISC 05/09/02 see # 9194
D906824-fluoro-1-benzylbenzene1-fluoranyl-4-(phenylmethyl)benzeneFT-0618529A8320181-Benzyl-4-fluorobenzene #SCHEMBL576415SCHEMBL1531987
Database identifiers
- CAS
587-79-1- PubChem CID
- 604241
- DTXSID
DTXSID20345405- EC Number
- 671-185-9
- Nikkaji
- J714.198J
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 153
Physicochemical properties
- Boiling point
- 94 °C · 94°C 1mm
- Density
- 1 · 1
- refractive index
- 1.554 to · 1.5540 to 1.5580
- form
- clear liquid
- color
- Colorless to Light yellow to Light orange
- Specific Gravity
- 1 · 1.0
- InChI
- InChI=1S/C13H11F/c14-13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h1-9H,10H2
- InChIKey
- ADCBAIUWZPOIMC-UHFFFAOYSA-N
- SMILES
- C1(F)=CC=C(CC2=CC=CC=C2)C=C1
- CAS DataBase Reference
- 587 · 587-79-1(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 233 · P233-P260-P261-P264-P271-P280-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
- Hazard Codes
- Xi
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2942000090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P233-P260-P261-P264-P271-P280-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
Chemistry & industry
Applications
Uses4-Fluorodiphenylmethane is a hydrocarbon halide, mainly used in organic synthesis and experimental research.
Suppliers40 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]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [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）400-0056266 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
Related reactions
1 records
Compound notes
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