Propionamidine hydrochloride

HCID 415117CAS 3599-89-1

Substructure search Find similar structures

Basic information

Standard SMILES: CCC(=N)N
InChIKey: GNFWGDKKNWGGJY-UHFFFAOYSA-N
Molecular formula: C3H8N2
Average molar mass: 72.11 g/mol
Monoisotopic mass: 72.06874826

Names & identifiers

Preferred name: Propionamidine hydrochloride
IUPAC: propanimidamide
English name: Propionamidine hydrochloride
Molecular formula: C3H8N2
Molecular weight: 72.11

Names & synonyms

RefChem:869650222-753-6Propionamidine hydrochloridepropanimidamide39800-84-5PROPIONIMIDAMIDEPropionamidinepropanamidinePropanimidamide (9CI)MFCD00939262Propionamidine HCl1-azanylpropylideneazanium

Show more names

propionimidamide hydrochloridePropanimidamide monoPROPIONAMIDINE HYDRCHLORIDEpropanimidamide HCl 0.2NH4Clpropanimidamide hydrochloridePropionamidine hydrochloride ,97%

propioamidineHVBSCHEMBL12181SCHEMBL292794SCHEMBL294544SCHEMBL4199289DTXSID90960366GNFWGDKKNWGGJY-UHFFFAOYSA-N

Database identifiers

CAS: 3599-89-1、39800-84-5
PubChem CID: 415117
DTXSID: DTXSID90960366
EC Number: 222-753-6、676-351-4
Nikkaji: J215.793D

Properties

Computed structural properties

XLogP: -0.3
Topological polar surface area: 49.9 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 5
Formal charge: 0
Complexity: 40.2

Physicochemical properties

Boiling point: 90.8 · 90.8±23.0 °C(Predicted)
Density: 0.99 · 0.99±0.1 g/cm3(Predicted)
storage temp.: 2 · 2-8°C(protect from light)
pka: 12.49 · 12.49±0.40(Predicted)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338

Safety & regulation

GHS classification

GHS Classification · 6 items

Warning

H315 (100%): 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 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]