HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

5-Benzoyl-2-(triisopropylsilyl)oxazole

HCID 16217751
New noteNew reactionRequest quotes
Print preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
648929-24-2
Standard SMILES
CC(C)[Si](c1ncc(C(=O)c2ccccc2)o1)(C(C)C)C(C)C
InChIKey
IJPGLDZXSJKFQQ-UHFFFAOYSA-N
Molecular formula
C19H27NO2Si
Average molar mass
329.5 g/mol
Monoisotopic mass
329.18110564

Names & identifiers

Preferred name
5-Benzoyl-2-(triisopropylsilyl)oxazole
IUPAC
phenyl-[2-tri(propan-2-yl)silyl-1,3-oxazol-5-yl]methanone
English name
5-BENZOYL-2-(TRIISOPROPYLSILYL)OXAZOLE
Molecular formula
C19H27NO2Si
Molecular weight
329.51

Names & synonyms

5-Benzoyl-2-(triisopropylsilyl)oxazoleRefChem:532547664-204-7648929-24-2Phenyl(2-(triisopropylsilyl)oxazol-5-yl)methanonephenyl-[2-tri(propan-2-yl)silyl-1,3-oxazol-5-yl]methanone2-triisopropylsilyl-5-benzoyloxazoleDTXSID00584532DS-016498phenyl[2-(triisopropylsilyl)-1,3-oxazol-5-yl]methanonePhenyl{2-[tri(propan-2-yl)silyl]-1,3-oxazol-5-yl}methanoneMethanone, phenyl[2-[tris(1-methylethyl)silyl]-5-oxazolyl]-

Database identifiers

CAS
648929-24-2
PubChem CID
16217751
DTXSID
DTXSID00584532
EC Number
664-204-7
Nikkaji
J2.001.199H

Properties

Computed structural propertiesFilling in

Topological polar surface area
43.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
23
Formal charge
0
Complexity
380

Physicochemical properties

Melting point
51 · 51-55 °C(lit.)
Boiling point
384 · 384.0±34.0 °C(Predicted)
Density
1.02 · 1.02±0.1 g/cm3(Predicted)
Flash point
110 °C · 110 °C
pka
-1 · -1.00±0.10(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
335 · H335-H315-H319
Precautionary statements
264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
23 · 23-24/25-26

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 · 4 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 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
23-24/25-26
Hazard statements
H335-H315-H319
Precautionary statements
P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes