Basic information
- CAS
6640-70-6- Standard SMILES
N#CCCNC(N)=O- InChIKey
KXLLKSHFFVQKTQ-UHFFFAOYSA-N- Molecular formula
- C4H7N3O
- Average molar mass
- 113.12 g/mol
- Monoisotopic mass
- 113.05891186
Overview
immunopotentiator
Names & identifiers
- Preferred name
- 2-Cyanoethylurea
- IUPAC
- 2-cyanoethylurea
- English name
- 2-cyanoethylurea
- Molecular formula
- C4H7N3O
- Molecular weight
- 113.12
Names & synonyms
2-Cyanoethylurea6640-70-62-Cyanethylcarbamide(2-Cyanoethyl)ureaUrea, (2-cyanoethyl)-QA7P2MYY6MNSC-49062DTXSID60216625RefChem:86582DTXCID90139116Urea, N-(2-cyanoethyl)-BA1-4
Show more names
2-cyano-ethyl ureaNSC 49062N-(2-Cyanoethyl)ureaUNII-QA7P2MYY6MSCHEMBL3967703NSC49062BA 1-4AKOS011945470
Database identifiers
- CAS
6640-70-6- PubChem CID
- 96033
- DTXSID
DTXSID60216625- UNII
- QA7P2MYY6M
- EC Number
- 661-543-2
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 122
Physicochemical properties
- FDA UNII
- 7 P2MYY6M · QA7P2MYY6M
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
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]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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