Basic information
- CAS
16867-03-1- Standard SMILES
Nc1ncccc1O- InChIKey
BMTSZVZQNMNPCT-UHFFFAOYSA-N- Molecular formula
- C5H6N2O
- Average molar mass
- 110.11 g/mol
- Monoisotopic mass
- 110.04801281
Overview
2-amino-3-hydroxypyridine is a monohydroxypyridine and an aminopyridine.
Names & identifiers
- Preferred name
- 2-Amino-3-Hydroxypyridine
- IUPAC
- 2-aminopyridin-3-ol
- English name
- 2-Amino-3-hydroxypyridine
- Molecular formula
- C5H6N2O
- Molecular weight
- 110.11
Names & synonyms
Show more names
Database identifiers
- CAS
16867-03-1- PubChem CID
- 28114
- DTXSID
DTXSID50168588- ChEMBL
CHEMBL4777856- ChEBI
CHEBI:195501- UNII
- P8740PEW4B
- EC Number
- 240-886-8
- Nikkaji
- J207.966F
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 59.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 76.8
Experimental & physicochemical properties
Cosmetics
Cosmetic ingredients (2-Amino-3-Hydroxypyridine) -> CIR (Cosmetic Ingredient Review)
Hair dyeing
Physicochemical properties
- Melting point
- 168 · 168-172 °C (lit.)
- Boiling point
- 206.4 °C · 206.4°C (rough estimate)
- Density
- 1.2111 · 1.2111 (rough estimate)
- vapor pressure
- 0.007 · 0.007-0.28Pa at 20-50℃
- refractive index
- 1.48 · 1.4800 (estimate)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- solubility
- DMSO (Slightly), Methanol (Slightly)
- pka
- 5.15 · 5.15±0.10(Predicted)
- form
- Crystalline Powder
- color
- Grayish-beige to brownish
- BRN
- 109868 · 109868
- Cosmetics Ingredients Functions
- HAIR DYEING
- Cosmetic Ingredient Review (CIR)
- 2 · 2-Amino-3-hydroxypyridine (16867-03-1)
- InChI
- 1S/C5H6N2O/c6-5-4(8)2-1-3-7-5/h1-3,8H,(H2,6,7)
- InChIKey
- BMTSZVZQNMNPCT-UHFFFAOYSA-N
- SMILES
- Nc1ncccc1O
- LogP
- -0.25 at · -0.25 at 23℃ and pH7.02-7.04
- Surface tension
- 72.6 mN/m · 72.6mN/m at 1.053g/L and 20℃
- CAS DataBase Reference
- 16867 · 16867-03-1(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1-3
- FDA UNII
- 8740 PEW4B · P8740PEW4B
- NIST Chemistry Reference
- 2 · 2-Amino-3-hydroxypyridine(16867-03-1)
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301-H315-H319
- Precautionary statements
- 301 · P301+P310+P330-P302+P352-P305+P351+P338
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xi,T,Xn
- Risk Statements
- 36 · 36/37/38-25-40
- Safety Statements
- 26 · 26-45-37/39-28A-36-22
- RIDADR
- 2811 · UN2811
- WGK Germany
- 3 · 3
- Hazard Note
- Irritant
- HazardClass
- 6.1 · 6.1
- PackingGroup
- III
- HS Code
- 29333999 · 29333999
- Storage Class
- 6.1 C · 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard Classifications
- 3 OralEye · Acute Tox. 3 OralEye Irrit. 2Skin Irrit. 2
- REACH Registrations
- Active
Safety & regulation
GHS classification
GHS Classification
Danger
H301 (15.7%): Toxic if swallowed [Danger Acute toxicity, oral]
P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 191 reports by companies from 27 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: 3-Pyridinol, 2-amino-
Status: Active Update: 25-09-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/20708
2-Amino-3-hydroxypyridine: Does not have an individual approval but may be used under an appropriate group standard
Toxicology
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- ridadr
- UN2811
- hs_code
- 29333999
- risk_code
- 36/37/38-25-40
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- hazard_code
- Xi,T,Xn
- hazard_note
- Irritant
- safety_code
- 26-45-37/39-28A-36-22
- hazard_class
- 6.1
- Storage Class
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- packing_group
- III
- Hazard statements
- H301-H315-H319
- REACH Registrations
- Active
- Hazard Classifications
- Acute Tox. 3 OralEye Irrit. 2Skin Irrit. 2
- Precautionary statements
- P301+P310+P330-P302+P352-P305+P351+P338
Chemistry & industry
Uses & manufacturing
Applications
Uses2-Amino-3-hydroxypyridine was used as reagent in reaction of dimethyl acetylenedicarboxylate and triphenylphosphine to yield functionalized coumarins and 1,4-oxazines.
General Description2-Amino-3-hydroxypyridine forms complexes with number of transition metals. It inhibits the corrosion of aluminium and copper in acidic solutions. It undergoes condensation with 2-hydroxy-1-naphthaldehyde and 2-hydroxybenzaldehyde to form Schiffs bases. It is useful in the preparation of clinical anti-inflammatory analgesics.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
Related reactions
Compound notes
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