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(5-Bromo-2-fluorophenyl)methanol

HCID 2773352
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
99725-13-0
Standard SMILES
OCc1cc(Br)ccc1F
InChIKey
UOSBHJFKMGLWGX-UHFFFAOYSA-N
Molecular formula
C7H6BrFO
Average molar mass
205.02 g/mol
Monoisotopic mass
203.95860513

Names & identifiers

Preferred name
(5-Bromo-2-fluorophenyl)methanol
IUPAC
(5-bromo-2-fluorophenyl)methanol
English name
5-Bromo-2-fluorobenzyl alcohol
Molecular formula
C7H6BrFO
Molecular weight
205.02

Names & synonyms

(5-bromo-2-fluorophenyl)methanolRefChem:403840619-456-25-Bromo-2-fluorobenzyl alcohol99725-13-0MFCD001434255-bromo-2-fluorobenzylalcohol5-Bromo-2-fluorobenzenemethanol(5-bromo-2-fluorophenyl)methan-1-ol(5-bromo-2-fluoro-phenyl)methanolSCHEMBL1351652-fluoro-5-bromobenzyl alcohol
Show more names
RARECHEM AL BD 0325Benzenemethanol, 5-bromo-2-fluoro-5-Bromo-2-fluorobenzylamine hydrochloride ISO 9001:2015 REACH
5-Bromo-2-fluoro-benzylalcoholSCHEMBL15352101SCHEMBL169600065-Bromo-2-fluoro-benzyl alcoholDTXSID703784005-Bromo-2-fluoro-phenyl-methanolUOSBHJFKMGLWGX-UHFFFAOYSA-N(5-bromo-2-fluoro-phenyl)-methanol

Database identifiers

CAS
99725-13-0
PubChem CID
2773352
DTXSID
DTXSID70378400
EC Number
619-456-2

Properties

Computed structural properties

XLogP
1.6
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

Melting point
221 · 221-226 °C(lit.)
Boiling point
82 · 82-87°/0.4mm
storage temp.
Sealed in dry,Room Temperature
Appearance
White to off-white Solid
CAS DataBase Reference
99725 · 99725-13-0(CAS DataBase Reference)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36
WGK Germany
3 · 3
Hazard Note
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 · 4 items

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 7 reports by companies from 4 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

wgk
3
hs_code
2906290090
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
hazard_note
Irritant
safety_code
26-36
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Applications

Uses5-Bromo-2-fluorobenzylamine hydrochloride is mainly used as an intermediate in organic synthesis, especially in the fields of medicine and materials science.

Upstream & downstream products

Upstream raw materials

2-(acetoxymethyl)-4-bromo-1-fluorobenzene5-Bromo-2-fluorobenzoic acid2-Fluoro-5-bromobenzyl bromide5-Bromo-2-fluorotoluene5-Bromo-2-fluorobenzaldehydeAmmonium chlorideMethanol

Suppliers87 total

湖北鑫立恒化工有限公司13164644252
常州帝通化工有限公司+86-0519-88298848 · [email protected]
苏州道澜生物医药科技有限公司15952404857 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
上海策嵘生物科技有限公司[email protected]

Related reactions

31 records
New reaction record
HRID 2779 reaction equation
HRID 2779As productuspto-grants-1998_03
HRID 2780 reaction equation
HRID 2780As reactantuspto-grants-1998_03
HRID 112650 reaction equation
HRID 112650As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 124846 reaction equation
HRID 124846As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 170140 reaction equation
HRID 170140As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 181923 reaction equation
HRID 181923As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 563785 reaction equation
HRID 563785As productuspto-grants-2011_11
HRID 563786 reaction equation
HRID 563786As reactantuspto-grants-2011_11
Page 1 of 4

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
上海衡新化工科技有限公司
13917104483; 13917104483 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
河北枫嘉新材料科技有限公司+86-0311-87836622 +86-18712993135 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
南京圣亿来化工有限公司19951936396 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [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]
天津津御达化工科技有限公司022-58013646 13011382049 · [email protected]
上海渤腾医药科技有限公司13524892556 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
越林试剂021-62960152 · [email protected]
苏州安尼康药物研发有限公司0512-69369885 · [email protected]
陕西麟邦实业有限公司17709134430 · [email protected]
南京世洲生物科技有限公司13675144456 · [email protected]
上海洪创医药科技有限公司18151128828 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海湄水化工科技有限公司021-60549325 18616193163
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
天津安浩生物科技有限公司[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]
南京恰风和医药科技有限公司025-57018978 18251899859 · [email protected]
济宁横渠生物技术有限公司18118824509 · [email protected]
南京代盟化工有限公司025-66800956 18800000000 · [email protected]
成都瑞欧克科技有限公司028-64353063 · [email protected]
北京禾兴源科技有限公司18511709189 · [email protected]
Henan Alfa Chemical Co., Ltd+8618339805032 · [email protected]
杭州安凯生物医药有限公司+86-0571-28186870; +undefined8613073685410 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
嘉兴市德亿化工有限公司0573-85866609 13325730825 · [email protected]
聊城莱博特生物医药科技有限公司0635-893290 · [email protected]
北京汇科盈生物科技有限公司15210661751 · [email protected]
上海思言生物科技有限公司021-50908862,442785678,326799392 18721037013 · [email protected]
含山捷化生物科技有限公司0555-18055517827 18055517827 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
上海瀚思化工有限公司17717618050 · [email protected]
菏泽星达医药科技有限公司13583079096 · [email protected]
安泰精细化工技术有限公司18503026267 · [email protected]
上海希凯姆医药开发有限公司13889470786 · [email protected]
上海康曼生物科技有限公司18800375331 · [email protected]
河南安基化工科技有限公司17836913271