2-(Pyridin-4-yl)pyrimidin-4-amine
Basic information
- CAS
61310-29-0- Standard SMILES
Nc1ccnc(-c2ccncc2)n1- InChIKey
AFNZWLWIUXHAIW-UHFFFAOYSA-N- Molecular formula
- C9H8N4
- Average molar mass
- 172.19 g/mol
- Monoisotopic mass
- 172.07489627
Names & identifiers
- Preferred name
- 2-(Pyridin-4-yl)pyrimidin-4-amine
- IUPAC
- 2-pyridin-4-ylpyrimidin-4-amine
- English name
- 2-(4-Pyridinyl)-4-pyrimidinamine
- Molecular formula
- C9H8N4
- Molecular weight
- 172.19
Names & synonyms
61310-29-02-(pyridin-4-yl)pyrimidin-4-amineDTXSID70384420RefChem:254746DTXCID403354442-(4-pyridinyl)-4-pyrimidinamine2-pyridin-4-ylpyrimidin-4-amineMFCD001198222-(4-Pyridyl)pyrimidin-4-amineCHEMBL354423SCHEMBL1018167AFNZWLWIUXHAIW-UHFFFAOYSA-N
Show more names
2-(4-pyridinyL)-4-pyrimidinamine4-Pyrimidinamine, 2-(4-pyridinyl)-2-(4-PYRIDINYL)-4-PYRIMIDINAMINE ISO 9001：2015 REACH
2-(4-pyridyl)pyrimidine-4-ylamine4-amino-2-(4-pyridinyl)pyrimidineLCA31029SBB0886504-amino-2-(4-pyridinyl)-pyrimidineAKOS005070209SB52586AC-31860
Database identifiers
- CAS
61310-29-0- PubChem CID
- 2804233
- DTXSID
DTXSID70384420- ChEMBL
CHEMBL354423- EC Number
- 977-014-7
- Nikkaji
- J578.944C
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 64.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 156
Physicochemical properties
- Melting point
- 262 · 262-264°C
- Hazard Codes
- Xn
- Risk Statements
- 20 · 20/21/22-36/37/38-22
- Safety Statements
- 26 · 26-36/37/39
- HazardClass
- IRRITANT
- HS Code
- 2933399990 · 2933399990
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, 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
- 2933399990
- risk_code
- 20/21/22-36/37/38-22
- hazard_code
- Xn
- safety_code
- 26-36/37/39
- hazard_class
- IRRITANT
Related reactions
1 records
Compound notes
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