Basic information
- CAS
261943-97-9- Standard SMILES
Cc1ccc(F)c(CC(=O)O)c1F- InChIKey
XMNMLOQKAUVILT-UHFFFAOYSA-N- Molecular formula
- C9H8F2O2
- Average molar mass
- 186.15 g/mol
- Monoisotopic mass
- 186.04923582
Names & identifiers
- Preferred name
- 2,6-Difluoro-3-methylphenylacetic acid
- IUPAC
- 2-(2,6-difluoro-3-methylphenyl)acetic acid
- English name
- 2,6-Difluoro-3-methylphenylacetic acid
- Molecular formula
- C9H8F2O2
- Molecular weight
- 186.16
Names & synonyms
261943-97-92,6-Difluoro-3-methylphenylacetic acidDTXSID40378917RefChem:248358DTXCID403299442-(2,6-difluoro-3-methylphenyl)acetic acidMFCD01631338(2,6-difluoro-3-methylphenyl)acetic acidBenzeneacetic acid, 2,6-difluoro-3-methyl-2-(2,6-difluoro-3-methyl-phenyl)acetic AcidSCHEMBL2142648SBB090370
Show more names
RARECHEM AL BO 09392,6-Difluoro-m-tolylacetic acid, 3-(Carboxymethyl)-2,4-difluorotoluene
AKOS005258508PS-8477SY0625612-(2,6-Difluoro-3-methylphenyl)aceticacidCS-0439144D96273EN300-1137705F005763
Database identifiers
- CAS
261943-97-9- PubChem CID
- 2774155
- DTXSID
DTXSID40378917- EC Number
- 670-744-4
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 196
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 271 · P271-P261-P280
- Hazard Codes
- Xi,T
- Risk Statements
- 36 · 36/37/38-25
- Safety Statements
- 26 · 26-36-45
- HazardClass
- IRRITANT
- HS Code
- 2916399090 · 2916399090
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 5 reports by companies from 2 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
- hs_code
- 2916399090
- risk_code
- 36/37/38-25
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,T
- safety_code
- 26-36-45
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P271-P261-P280
Chemistry & industry
Suppliers18 total
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [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]
北京依特能化学科技有限责任公司010-59484199 18611897322;18611897322 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
常州安赛普化工有限公司0519-86305871 13961213398 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
上海皓鸿生物医药科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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