3-Hydroxy-N-(2-hydroxyethyl)-2-naphthoamide
Basic information
- CAS
92-80-8- Standard SMILES
O=C(NCCO)c1cc2ccccc2cc1O- InChIKey
VYHNSPUVKZPCDZ-UHFFFAOYSA-N- Molecular formula
- C13H13NO3
- Average molar mass
- 231.25 g/mol
- Monoisotopic mass
- 231.08954328
Names & identifiers
- Preferred name
- 3-Hydroxy-N-(2-hydroxyethyl)-2-naphthoamide
- IUPAC
- 3-hydroxy-N-(2-hydroxyethyl)naphthalene-2-carboxamide
- English name
- 2-Hydroxy-3-naphthoic acid ethanolamide
- Molecular formula
- C13H13NO3
- Molecular weight
- 231.25
Names & synonyms
92-80-83-Hydroxy-N-(2-hydroxyethyl)naphthalene-2-carboxamide2-Naphthalenecarboxamide, 3-hydroxy-N-(2-hydroxyethyl)-3-hydroxy-N-(2-hydroxyethyl)-2-naphthalenecarboxamideR909LHN7LQ3-Hydroxy-2-naphthoic acid, ethanolamideEINECS 202-191-82-Naphthamide, 3-hydroxy-N-(2-hydroxyethyl)-NSC 60579NSC-60579beta-(2-Hydroxy-3-naphthoyl)aminoethanol.beta.-(2-Hydroxy-3-naphthoyl)aminoethanol
Show more names
2-Hydroxy-3-naphthoic acid ethanolamide3-Hydroxy-N-(2-hydroxyethyl)-2-napthamide3-HYDROXY-N-(2-HYDROXYETHYL)-2-NAPHTHAMIDE2-Hydroxy-3-naphthoic acid-N-ethanoylamide2-Hydroxy-3-[(2-hydroxyethyl)carbamoyl]naphthalene3-HYDROXY-2-NAPHTHOIC ACID, N-(2-HYDROXYETHYL)AMIDE
DTXSID70590683-Hydroxy-N-(2-hydroxyethyl)-2-naphthoamide2-Hydroxy-3-(beta-hydroxyethylamidocarbonyl)naphthalene2-HYDROXY-3-N-(2-HYDROXYETHYL)NAPHTHAMIDEN-(.BETA.-HYDROXYETHYL)-3-HYDROXY-2-NAPHTHAMIDE2-HYDROXY-3-NAPHTHOIC ACID-(2-HYDROXYETHYL)AMIDE2-HYDROXYNAPHTHALENE-3-(N-(.BETA.-HYDROXYETHYL)CARBOXAMIDE)RefChem:502495
Database identifiers
- CAS
92-80-8- PubChem CID
- 66722
- DTXSID
DTXSID7059068- ChEMBL
CHEMBL1557332- UNII
- R909LHN7LQ
- EC Number
- 202-191-8
- Nikkaji
- J170.894E
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 269
Physicochemical properties
- Melting point
- 134 °C · 134 °C
- Boiling point
- 520.1 · 520.1±35.0 °C(Predicted)
- Density
- 1.311 · 1.311±0.06 g/cm3(Predicted)
- pka
- 8.78 · 8.78±0.40(Predicted)
- FDA UNII
- 909 LHN7LQ · R909LHN7LQ
- EPA Substance Registry System
- 2 · 2-Naphthalenecarboxamide, 3-hydroxy-N-(2-hydroxyethyl)- (92-80-8)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- TSCA
- TSCA listed
- HS Code
- 2922210060 · 2922210060
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]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory InformationChemical: 2-Naphthalenecarboxamide, 3-hydroxy-N-(2-hydroxyethyl)-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- tsca
- TSCA listed
- hs_code
- 2922210060
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Naphthalenecarboxamide, 3-hydroxy-N-(2-hydroxyethyl)-: INACTIVE
Upstream & downstream products
Upstream raw materials
Suppliers
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Related reactions
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Compound notes
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