Basic information
- CAS
86610-66-4- Standard SMILES
O=C(Oc1ccc(C(Br)(c2ccc(OC(=O)c3ccccc3)cc2)c2ccc(OC(=O)c3ccccc3)cc2)cc1)c1ccccc1- InChIKey
PKXTVZCJOBWKIG-UHFFFAOYSA-N- Molecular formula
- C40H27BrO6
- Average molar mass
- 683.5 g/mol
- Monoisotopic mass
- 682.0991
Names & identifiers
- Preferred name
- (Bromomethanetriyl)tri(4,1-phenylene) tribenzoate
- IUPAC
- [4-[bis(4-benzoyloxyphenyl)-bromomethyl]phenyl] benzoate
- English name
- 4,4',4''-Tris(benzoyloxy)trityl bromide
- Molecular formula
- C40H27BrO6
- Molecular weight
- 683.54
Names & synonyms
DTXSID70398062(Bromomethanetriyl)tri(4,1-phenylene) tribenzoateRefChem:1050826DTXCID7034892186610-66-44,4',4''-Tris(benzoyloxy)trityl bromide(Bromomethanetriyl)tris(benzene-4,1-diyl) tribenzoateMFCD00010302[4-[bis(4-benzoyloxyphenyl)-bromomethyl]phenyl] benzoate4,4,4-Tris(benzoyloxy)trityl Bromide [Hydroxyl Protecting Agent]4,4',4''-Tris(benzoyloxy)trityl Bromide [Hydroxyl Protecting Agent]Tris[4-(phenylcarbonyloxy)phenyl]methyl Bromide
Show more names
Tris(4-benzoyloxyphenyl)methyl bromide4,4,4'-TRIS(BENZOYLOXY)TRITYL BROMIDE 97+%4,4',4''-(Bromomethylidyne)trisphenol tribenzoateREF DUPL: 4,4',4''-Tris(benzoyloxy)trityl Bromide4,4′,4′′-Tris(benzoyloxy)trityl bromide, CAS 86610-66-4Phenol, 4,4',4''-(bromomethylidyne)tris-, 1,1',1''-tribenzoate4,4',4''-(bromomethanetriyl)tris(benzene-4,1-diyl) tribenzoate
C40H27BrO6SCHEMBL8775664[4-[bis(4-benzoyloxyphenyl)-bromo-methyl]phenyl] BenzoatePKXTVZCJOBWKIG-UHFFFAOYSA-NAKOS015902797SY054578DB-252902CS-0357306
Properties
Computed structural properties
- XLogP
- 9.9
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 12
- Heavy atoms
- 47
- Formal charge
- 0
- Complexity
- 877
Physicochemical properties
- Melting point
- 187 · 187-189 °C(lit.)
- form
- powder to crystal
- color
- Light yellow to Brown
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
- F
- 3 · 3-10-21
- HS Code
- 2916.39 · 2916.39.7900
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 40 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- F
- 3-10-21
- wgk
- 3
- hs_code
- 2916.39.7900
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers26 total
北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Aladdin Scientific[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]
成都添福瑞生物科技有限公司18030648795 18030648795 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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