(2H4)Urea
Basic information
- CAS
1433-11-0- Standard SMILES
[2H]N([2H])C(=O)N([2H])[2H]- InChIKey
XSQUKJJJFZCRTK-JBISRTOLSA-N- Molecular formula
- CH4N2O
- Average molar mass
- 64.08 g/mol
- Monoisotopic mass
- 64.05746974
Names & identifiers
- Preferred name
- (2H4)Urea
- IUPAC
- 1,1,3,3-tetradeuteriourea
- English name
- Urea-d4
- Molecular formula
- CD4N2O
- Molecular weight
- 64.08
Names & synonyms
Urea-d41433-11-0(2H4)UreaEINECS 215-857-8DTXSID00162379RefChem:396733DTXCID8084870215-857-81,1,3,3-tetradeuterioureaUrea-d?(?H?)ureaUrea-d4, 98 atom % D
Show more names
Urea-d4 NO.Carbamide-d?Urea (D?, 98%)UREA (D4, 98%)(1,1,3,3-2H4)UreaUrea-d4,98 atom % D
(~2~H_4_)Ureaorb3138712SCHEMBL11920212TMID-0923HY-Y0271S1MSK005142D4AKOS015913207CS-0534877
Database identifiers
- CAS
1433-11-0- PubChem CID
- 2723980
- DTXSID
DTXSID00162379- EC Number
- 215-857-8
- Nikkaji
- J298.619A
Properties
Computed structural properties
- XLogP
- -1.4
- Topological polar surface area
- 69.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 4
- Formal charge
- 0
- Complexity
- 29
Physicochemical properties
- Melting point
- 132 · 132-135 °C (lit.)
- storage temp.
- Room Temperature, Under inert atmosphere
- solubility
- DMSO (Sparingly, Sonicated), Methanol (Slightly), Water (Slightly)
- form
- Solid
- color
- White to Off-White
- InChI
- 1S/CH4N2O/c2-1(3)4/h(H4,2,3,4)/i/hD4
- InChIKey
- XSQUKJJJFZCRTK-JBISRTOLSA-N
- SMILES
- [2H]N([2H])C(=O)N([2H])[2H]
- UNSPSC Code
- 12352116 · 12352116
- NACRES
- 12 · NA.12
- CAS Number Unlabeled
- 57 · 57-13-6
- PPE
- 3 · Eyeshields, Gloves, type P3 (EN 143) respirator cartridges
- Hazard Codes
- Xn
- Risk Statements
- 36 · 36/37/38-40
- Safety Statements
- 22 · 22-26-36
- WGK Germany
- 3 · 3
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
This chemical does not meet GHS hazard criteria for 100% (38 of 38) of all reports.
Not Classified
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesNot Classified
Safety data
- PPE
- Eyeshields, Gloves, type P3 (EN 143) respirator cartridges
- wgk
- 3
- risk_code
- 36/37/38-40
- hazard_code
- Xn
- safety_code
- 22-26-36
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Applications
UsesLabelled Urea. Physiological regulator of nitrogen excretion in mammals; synthesized in the liver as an end-product of protein catabolism and excreted in urine. Also occurs normally in skin. Emollient; diuretic.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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