1,6-Naphthyridine-2-carboxylic acid
Basic information
- CAS
197507-59-8- Standard SMILES
O=C(O)c1ccc2cnccc2n1- InChIKey
OZZMWXQJCJUCEJ-UHFFFAOYSA-N- Molecular formula
- C9H6N2O2
- Average molar mass
- 174.16 g/mol
- Monoisotopic mass
- 174.04292743
Names & identifiers
- Preferred name
- 1,6-Naphthyridine-2-carboxylic acid
- IUPAC
- 1,6-naphthyridine-2-carboxylic acid
- English name
- 1,6-Naphthyridine-2-carboxylic acid
- Molecular formula
- C9H6N2O2
- Molecular weight
- 174.16
Names & synonyms
1,6-Naphthyridine-2-carboxylic acid197507-59-8DTXSID00352879RefChem:221632DTXCID60303943674-417-71,6-Naphthyridine-2-carboxylicacid[1,6]naphthyridine-2-carboxylic acidMFCD00202908Peakdale1_000097CS-D01762-[1,6]naphthyridinecarboxylic acid
Show more names
1,6-naphthyridine-2-carboxylate2-Carboxy-1,6-naphthyridine1,6phthyridine-2-carboxylic acid1,6-Naphthyridine-2-carboxylic acid 95+%
EN300-252879Z12016197321,6-NaphtFT-0643841SCHEMBL1016413SCHEMBL1502050HMS518E09AC-951
Database identifiers
- CAS
197507-59-8- PubChem CID
- 735908
- DTXSID
DTXSID00352879- EC Number
- 674-417-7
- Nikkaji
- J1.413.115I
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 63.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 208
Physicochemical properties
- Melting point
- 290 · 290
- Boiling point
- 385.8 · 385.8±27.0 °C(Predicted)
- Density
- 1.421 · 1.421±0.06 g/cm3(Predicted)
- Flash point
- 187 °C · 187 °C
- storage temp.
- 2 · 2-8°C
- pka
- 3.77 · 3.77±0.30(Predicted)
- Appearance
- White to light brown Solid
- CAS DataBase Reference
- 197507 · 197507-59-8(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 305 · P305+P351+P338
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36
- Safety Statements
- 26 · 26
- WGK Germany
- 3 · 3
- Hazard Note
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
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 42 reports by companies from 4 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- wgk
- 3
- hs_code
- 2933998090
- risk_code
- 36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 26
- Hazard statements
- H319
- Precautionary statements
- P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
91 records
Compound notes
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