Basic information
- Standard SMILES
c1ccc(Nc2ccccn2)nc1- InChIKey
HMMPCBAWTWYFLR-UHFFFAOYSA-N- Molecular formula
- C10H9N3
- Average molar mass
- 171.2 g/mol
- Monoisotopic mass
- 171.07964729
Overview
structure in first source
Names & identifiers
- Preferred name
- 2,2'-Dipyridylamine
- IUPAC
- N-pyridin-2-ylpyridin-2-amine
- English name
- 2,2'-Dipyridylamine
- Molecular formula
- C10H9N3
- Molecular weight
- 171.2
Names & synonyms
Show more names
Database identifiers
- CAS
1202-34-2- PubChem CID
- 14547
- DTXSID
DTXSID5061619- ChEMBL
CHEMBL1735909- UNII
- X9BF664YAK
- EC Number
- 214-864-3
- Nikkaji
- J149.320E
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 37.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 133
Physicochemical properties
- Melting point
- 90 · 90-92 °C(lit.)
- Boiling point
- 222 °C50 · 222 °C50 mm Hg(lit.)
- Density
- 1.1984 · 1.1984 (rough estimate)
- refractive index
- 1.655 · 1.6550 (estimate)
- Flash point
- 170 °C · 170 °C
- storage temp.
- 2 · 2-8°C
- solubility
- Acetonitrile (Slightly), Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 4.79 · 4.79±0.10(Predicted)
- color
- White to Off-White
- BRN
- 127131 · 127131
- InChI
- InChI=1S/C10H9N3/c1-3-7-11-9(5-1)13-10-6-2-4-8-12-10/h1-8H,(H,11,12,13)
- InChIKey
- HMMPCBAWTWYFLR-UHFFFAOYSA-N
- SMILES
- C1(NC2=NC=CC=C2)=NC=CC=C1
- CAS DataBase Reference
- 1202 · 1202-34-2(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 9 BF664YAK · X9BF664YAK
- EPA Substance Registry System
- 2 · 2-Pyridinamine, N-2-pyridinyl- (1202-34-2)
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 24 · NA.24
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 305 · P305+P351+P338
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- RIDADR
- 3545 · UN 3545
- WGK Germany
- 3 · 3
- RTECS
- 3545000 · UR3545000
- TSCA
- TSCA listed
- HS Code
- 29333990 · 29333990
- Storage Class
- 11 · 11 - Combustible Solids
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (97.6%): 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)
Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- UR3545000
- ridadr
- UN 3545
- hs_code
- 29333990
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P305+P351+P338
Chemistry & industry
Uses & manufacturing
Applications
Description2,2′-Dipyridylamine is an organic compound with the formula (C5H4N)2NH. It consists of a pair of 2-pyridyl groups (C5H4N) linked to a secondary amine. The compound forms a range of coordination complexes.Its conjugate base, 2,2′-dipyridylamide, forms extended metal atom chains.
Uses2,2′-Dipyridylamine (bipyam) can be used:As a bidentate N-donor ligand in the synthesis of various metal complexes.To synthesize Pd-polyoxovanadates, heterogeneous catalyst for the oxidation of benzylic hydrocarbons.
UsesA metal-complexing agent; an effective iron chelating agent to help protect against UVB radiation. An impurity of Chlorpheniramine Maleate (C424300).
General DescriptionPharmaceutical secondary standards for application in quality control, provide pharma laboratories and manufacturers with a convenient and cost-effective alternative to the preparation of in-house working standards.
Upstream & downstream products
Upstream raw materials
Suppliers50 total
Related reactions
Linked notes
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