Nicotinamidine hydrochloride

HCID 202042

Notes Reactions

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Basic information

CAS: 63265-42-9
Standard SMILES: Cl.N=C(N)c1cccnc1
InChIKey: MKJPBOVLAZADQJ-UHFFFAOYSA-N
Molecular formula: C6H8ClN3
Average molar mass: 157.6 g/mol
Monoisotopic mass: 157.04067494

Names & identifiers

Preferred name: Nicotinamidine hydrochloride
IUPAC: pyridine-3-carboximidamide;hydrochloride
English name: nicotinamidine hydrochloride
Molecular formula: C6H8ClN3
Molecular weight: 157.6

Names & synonyms

Nicotinamidine hydrochloride63265-42-9Pyridine-3-carboximidamide MonohydrochlorideRefChem:854109615-990-5692-380-57356-60-7Nicotinimidamide hydrochloride3-Amidinopyridine hydrochloridepyridine-3-carboximidamide hydrochloride3-AMIDINOPYRIDINIUM CHLORIDENicotinamidine, hydrochloride

Show more names

nicotinamidine,hydrochlorideNicotinimidamide dihydrochloride

3-Pyridinecarboximidamide, monohydrochlorideMFCD000543263-Pyridinecarboxamidine hydrochloridepyridine-3-carboximidamide;hydrochlorideNicotinimidamide xhydrochlorideNSC-64953pyridine-3-carboxamidine hydrochloride477903-33-6

Database identifiers

CAS: 63265-42-9、7356-60-7
PubChem CID: 202042
DTXSID: DTXSID901380347
UNII: A3EZ6T4MZE
EC Number: 615-990-5、692-380-5

Properties

Computed structural properties

Topological polar surface area: 62.8 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 10
Formal charge: 0
Complexity: 111

Physicochemical properties

Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 319 · H319-H335-H315-H302+H312+H332
Precautionary statements: 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
HazardClass: IRRITANT

Safety & regulation

GHS classification

GHS Classification · 6 items

Warning

H302 (16.7%): 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)

Aggregated GHS information provided per 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

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]

Hazard information

Hazard Classes and Categories · 2 items

Acute Tox. 4 (16.7%)

Acute Tox. 4 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS07
hazard_class: IRRITANT
Hazard statements: H319-H335-H315-H302+H312+H332
Precautionary statements: P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P