Basic information
- CAS
1247461-08-0- Standard SMILES
O=C(O)C(F)(F)c1cccnc1- InChIKey
AKIMTELMZIXCAV-UHFFFAOYSA-N- Molecular formula
- C7H5F2NO2
- Average molar mass
- 173.12 g/mol
- Monoisotopic mass
- 173.02883473
Names & identifiers
- Preferred name
- 2,2-Difluoro-2-(pyridin-3-yl)acetic acid
- IUPAC
- 2,2-difluoro-2-pyridin-3-ylacetic acid
- English name
- Difluoro-pyridin-3-yl-acetic acid
- Molecular formula
- C7H5F2NO2
- Molecular weight
- 173.12
Names & synonyms
2,2-Difluoro-2-(pyridin-3-yl)acetic acid1247461-08-0RefChem:441044825-507-1MFCD167488622,2-Difluoro-2-(3-pyridyl)acetic Acid2,2-difluoro-2-pyridin-3-ylacetic acidalpha,alpha-Difluoro-3-pyridineacetic acidSCHEMBL22285459AKIMTELMZIXCAV-UHFFFAOYSA-NXZB46108|A,|A-Difluoro-3-pyridineacetic acid
Show more names
Difluoro-pyridin-3-yl-acetic acidα,α-Difluoro-3-pyridineacetic acid3-Pyridineacetic acid, α,α-difluoro-
AKOS011682062AT36634SY3097202,2-Difluoro-2-(pyridin-3-yl)aceticacidCS-0235004EN300-151620F652964
Database identifiers
- CAS
1247461-08-0- PubChem CID
- 62394855
- EC Number
- 825-507-1
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 184
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H335-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers11 total
杭州品高化工有限公司0571-87658025 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
NINGBOBENKANGJS PHARMTECHCO., LTD+8615990591583 15990591583
宁波苯康基石医药科技有限公司15990591583
泰州市众致生物科技有限公司[email protected] 15066129350 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 13651849907 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
上海林栎生物科技有限公司13761635123 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
佰美济华（河南）医药科技有限公司0371-88900765 18037465274 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +8619957148339 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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