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2,3,5-Trifluorobenzyl bromide

HCID 2777052
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
226717-83-5
Standard SMILES
Fc1cc(F)c(F)c(CBr)c1
InChIKey
QPMAEHBAXJSICW-UHFFFAOYSA-N
Molecular formula
C7H4BrF3
Average molar mass
225.01 g/mol
Monoisotopic mass
223.94485

Names & identifiers

Preferred name
2,3,5-Trifluorobenzyl bromide
IUPAC
1-(bromomethyl)-2,3,5-trifluorobenzene
English name
2,3,5-Trifluorobenzyl bromide
Molecular formula
C7H4BrF3
Molecular weight
225.01

Names & synonyms

2,3,5-Trifluorobenzyl bromide226717-83-5DTXSID20380351RefChem:244199DTXCID103313771-(bromomethyl)-2,3,5-trifluorobenzeneMFCD000835432,3,5-trifluorobenzylbromideBenzene, 1-(bromomethyl)-2,3,5-trifluoro-1-bromomethyl-2,3,5-trifluoro-benzene1-(bromomethyl)-2,3,5-trifluoro-benzeneSCHEMBL489929
Show more names
Trifluorobenzylbromide 235-à-bromo-2,3,5-trifluorotoluene2,3,5-Trifluorobenzylbromide97%2,3,5-Trifluorobenzyl bromide 97%alpha-Bromo-2,3,5-trifluorotoluene
QPMAEHBAXJSICW-UHFFFAOYSA-NCK2039SBB070827AKOS015854299AC-26204AS-45853SY227787F007968

Database identifiers

CAS
226717-83-5
PubChem CID
2777052
DTXSID
DTXSID20380351
EC Number
671-776-1

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
11
Formal charge
0
Complexity
131

Physicochemical properties

refractive index
1.505 · 1.505
form
liquid
color
Clear, colourless
Sensitive
Lachrymatory
BRN
8311831 · 8311831
CAS DataBase Reference
226717 · 226717-83-5(CAS DataBase Reference)
Symbol(GHS)
5 · GHS05
Signal word
Danger
Hazard statements
314 · H314-H318
Precautionary statements
260 h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a · P260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a
Hazard Codes
C,T
Risk Statements
34 · 34-36-25
Safety Statements
26 · 26-36/37/39-45
RIDADR
3265 · 3265
Hazard Note
Corrosive/Lachrymatory
HazardClass
8 · 8
PackingGroup
II
HS Code
2903998090 · 2903998090
Limited Quantities
5 L · 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
Excepted Quantities
Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)

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 · 5 items

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H319 (20%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P321, P337+P317, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesSkin Corr. 1B (100%);Eye Irrit. 2 (20%)

Safety data

ridadr
3265
hs_code
2903998090
risk_code
34-36-25
Signal word
Danger
Symbol(GHS)
GHS05
hazard_code
C,T
hazard_note
Corrosive/Lachrymatory
safety_code
26-36/37/39-45
hazard_class
8
packing_group
II
Hazard statements
H314-H318
Limited Quantities
5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
Excepted Quantities
Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Precautionary statements
P260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a

Chemistry & industry

Suppliers31 total

毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
Changzhou Anxuan Chemical Co., Ltd+86-0519-89882563 +86-18961279162 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Syntechem Co.,Ltd[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [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]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
常州安轩化工有限公司13912302692 · [email protected]
黄石精驰医药有限公司17771967576; 17771967576 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
上海石洋化工有限公司021-56795766 · [email protected]
天津安浩生物科技有限公司[email protected]
北京禾兴源科技有限公司18511709189 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
Zjartspharm Co., Ltd15068876005 · [email protected]
广东翁江化学试剂有限公司0751-2815688 13927872512 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
重庆卡兰医药有限公司[email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
HANGZHOU CLAP TECHNOLOGY CO.,LTD86-571-88216897,88216896 13588875226 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]
JACS-郑州杰克斯化工产品有限公司0371-86259281 13223061139 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
上海信旗医药科技有限公司+86-21-54098501 · [email protected]

Related reactions

5 records
New reaction record
HRID 140611 reaction equation
HRID 140611As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 750569 reaction equation
HRID 750569As reactantuspto-grants-2008_07
HRID 1266359 reaction equation
HRID 1266359As reactantuspto-grants-2003_04
HRID 1712132 reaction equation
HRID 1712132As reactantuspto-grants-2010_09
HRID 1977846 reaction equation
HRID 1977846As reactantuspto-grants-2001_05

Compound notes

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