Basic information
- CAS
1685-19-4- Standard SMILES
CC(=O)c1cc(Cl)ccc1N- InChIKey
AQBCDAORSNHFNR-UHFFFAOYSA-N- Molecular formula
- C8H8ClNO
- Average molar mass
- 169.61 g/mol
- Monoisotopic mass
- 169.0294416
Names & identifiers
- Preferred name
- 1-(2-Amino-5-chlorophenyl)ethanone
- IUPAC
- 1-(2-amino-5-chlorophenyl)ethanone
- English name
- Ethanone,1-(2-amino-5-chlorophenyl)-
- Molecular formula
- C8H8ClNO
- Molecular weight
- 169.61
Names & synonyms
1-(2-Amino-5-chlorophenyl)ethanone1685-19-4Ethanone, 1-(2-amino-5-chlorophenyl)-MFCD07434611Ethanone,1-(2-amino-5-chlorophenyl)-2'-Amino-5'-chloroacetophenone1-(2-amino-5-chlorophenyl)ethan-1-oneSCHEMBL1189140DTXSID80543006CK2563AMY27944AKOS005135902
Show more names
Chloroprocaine Impurity 41(2-AMino-5-chlorophenyl)ethanone
CS-W005834AC-22651DS-11228SY035053EN300-215694F221596Z11981732832 inverted exclamation mark -Amino-5 inverted exclamation mark -chloroacetophenone
Database identifiers
- CAS
1685-19-4- PubChem CID
- 13528343
- DTXSID
DTXSID80543006- EC Number
- 117-545-6
- Nikkaji
- J417.396A
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 160
Physicochemical properties
- Melting point
- 65 · 65-66 °C
- Boiling point
- 305.1 · 305.1±27.0 °C(Predicted)
- Density
- 1.254 · 1.254±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C(protect from light)
- pka
- 1.67 · 1.67±0.10(Predicted)
- Appearance
- Light yellow to brown Solid
- HS Code
- 2922390090 · 2922390090
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, 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 CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2922390090
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers70 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]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
Suzhou Victorypharm Co.,Ltd.+86-13916956214 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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