3-(4-tert-Butylphenyl)-1,1-dimethylurea
Basic information
- CAS
32745-69-0- Standard SMILES
CN(C)C(=O)Nc1ccc(C(C)(C)C)cc1- InChIKey
HISRRIPMKSWSQV-UHFFFAOYSA-N- Molecular formula
- C13H20N2O
- Average molar mass
- 220.31 g/mol
- Monoisotopic mass
- 220.15756327
Names & identifiers
- Preferred name
- 3-(4-tert-Butylphenyl)-1,1-dimethylurea
- IUPAC
- 3-(4-tert-butylphenyl)-1,1-dimethylurea
- English name
- 3-(4-tert-Butylphenyl)-1,1-dimethylurea
- Molecular formula
- C13H20N2O
- Molecular weight
- 220.31
Names & synonyms
3-(4-tert-Butylphenyl)-1,1-dimethylurea32745-69-0DTXSID20186416RefChem:92491DTXCID30108907666-419-11-(4-tert-butylphenyl)-3,3-dimethylureaHMS1667P04SCHEMBL9722104CCG-44449AKOS002948267N'-(4-tert-Butylphenyl)-N,N-dimethylurea
Show more names
CRD-69-6292Urea, N'-[4-(1,1-dimethylethyl)phenyl]-N,N-dimethyl-
SR-01000634283-1
Database identifiers
- CAS
32745-69-0- PubChem CID
- 94440
- DTXSID
DTXSID20186416- EC Number
- 666-419-1
- Nikkaji
- J18.091B
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 235
Experimental & physicochemical properties
LogP3.1
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 317 · H317
- Precautionary statements
- 261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-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
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Sens. 1 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H317
- Precautionary statements
- P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…