1,1-Diethylguanidine hydrochloride

HCID 70686CAS 1114-39-2
Substructure searchFind similar structures

Basic information

Standard SMILES
CCN(CC)C(=N)N.Cl
InChIKey
BUFXTZQKWHOGPE-UHFFFAOYSA-N
Molecular formula
C5H14ClN3
Average molar mass
151.64 g/mol
Monoisotopic mass
151.08762513

Names & identifiers

Preferred name
1,1-Diethylguanidine hydrochloride
IUPAC
1,1-diethylguanidine;hydrochloride
English name
1,1-diethylguanidine hydrochloride
Molecular formula
C5H14ClN3
Molecular weight
151.63776

Names & synonyms

1,1-Diethylguanidine hydrochloride1114-39-2EINECS 214-213-3DTXSID00149645RefChem:409841DTXCID6072136214-213-31,1-diethylguanidine;hydrochlorideN,N-Diethylguanidine hydrochlorideMFCD00035042Guanidine, N,N-diethyl-, monohydrochloride1,1-Diethylguanidine HCl
Show more names
HYDROGEN 1,1-DIETHYLGUANIDINE CHLORIDEGuanidine,N,N-diethyl-, hydrochloride (1:1)
SCHEMBL31934051,1-DiethylguanidinehydrochlorideAKOS024333067CS-10202DB-300835NS00044354A11426N,N-Diethylguanidine--hydrogen chloride (1/1)

Database identifiers

CAS
1114-39-2
PubChem CID
70686
DTXSID
DTXSID00149645
EC Number
214-213-3

Properties

Computed structural properties

Topological polar surface area
53.1 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
9

Physicochemical properties

Melting point
148 · 148-149 °C
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
HS Code
2925290090 · 2925290090

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

hs_code
2925290090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P280-P301+P312-P302+P352-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Suppliers12 total

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
上海钰康生物科技有限公司18939844854 · [email protected]
上海攀鸿化工科技有限公司021-56491756 13512199871 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]

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