Pyridine-4-amidine hydrochloride
Basic information
- CAS
42518-06-9- Standard SMILES
Cl.N=C(N)c1ccncc1- InChIKey
IONKMFGAXKCLMI-UHFFFAOYSA-N- Molecular formula
- C6H8ClN3
- Average molar mass
- 157.6 g/mol
- Monoisotopic mass
- 157.040675
Overview
See also: [Amino(pyridin-4-yl)methylidene]azanium (annotation moved to).
Names & identifiers
- Preferred name
- Pyridine-4-amidine hydrochloride
- IUPAC
- pyridine-4-carboximidamide;hydrochloride
- English name
- 4-Amidinopyridinium chloride
- Molecular formula
- C6H8ClN3
- Molecular weight
- 157.6
Names & synonyms
42518-06-9RefChem:870749Pyridine-4-amidine hydrochloride692-231-4Isonicotinimidamide hydrochloride6345-27-3Pyridine-4-carboximidamide Hydrochloride4-Amidinopyridine hydrochlorideIsonicotinamidine hydrochloride4-AMIDINOPYRIDINIUM CHLORIDEMFCD00040385pyridine-4-carboxamidine hydrochloride
Show more names
BUTTPARK 32\03-564-methylamidinopyridine chloride4-AMIDINOPYRIDINIUM HYDROCHLORIDEPYRIDINE-4-CARBOXIMIDAMIDE HYDRATE HCL4-PYRIDINECARBOXIMIDAMIDE, HYDROCHLORIDE
Isonicotinimidamide xhydrochloride4-pyridinecarboximidamide hydrochloride4-AMIDINOPYRIDINE HYDROCHLORIDEPYRIDINE-4-CARBOXIMIDAMIDE HYDROCHLORIDEIsonicotinimidamide hydrochloride(1:x)pyridine-4-carboximidamide;hydrochlorideIsonicotinamidine, HydrochlorideEN300-426644-Pyridinecarboximidamide, monohydrochloride
Database identifiers
- CAS
42518-06-9、6345-27-3- PubChem CID
- 2776844
- EC Number
- 692-231-4
Properties
Computed structural properties
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 105
Physicochemical properties
- Melting point
- 263 °C · 263 °C
- storage temp.
- Inert atmosphere,Room Temperature
- Appearance
- White to off-white Solid
- InChI
- InChI=1S/C6H7N3.ClH/c7-6(8)5-1-3-9-4-2-5;/h1-4H,(H3,7,8);1H
- InChIKey
- IONKMFGAXKCLMI-UHFFFAOYSA-N
- SMILES
- C(C1=CC=NC=C1)(N)=N.Cl
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H315-H319-H332-H335
- Precautionary statements
- 233 · P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P322-P330-P332+P313-P337+P313-P340-P362-P363-P403-P403+P233-P405-P501
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-37/39
- HazardClass
- IRRITANT
- HS Code
- 29333990 · 29333990
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+H312+H332 (100%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, 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
- 29333990
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-37/39
- hazard_class
- IRRITANT
- Hazard statements
- H302-H312-H315-H319-H332-H335
- Precautionary statements
- P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P322-P330-P332+P313-P337+P313-P340-P362-P363-P403-P403+P233-P405-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
33 records
Compound notes
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