CAS 39910-98-0 4-Morpholinoacetophenone (HCID 38362)

Names & identifiers

Preferred name: 4-Morpholinoacetophenone
IUPAC: 1-(4-morpholin-4-ylphenyl)ethanone
English name: 4-MORPHOLINOACETOPHENONE
Molecular formula: C12H15NO2
Molecular weight: 205.25

Names & synonyms

39910-98-04'-Morpholinoacetophenone4-MorpholinoacetophenoneACETOPHENONE, 4'-MORPHOLINO-p-MorpholinoacetophenoneVJ32JDU2T4BRN 1214737EINECS 254-698-9DTXSID30192967RefChem:525788DTXCID70115458254-698-9

Show more names

AKOS B022386LABOTEST-BB LT00440858-Morpholinoacetophenone4-MORPHOLINEACETOPHENONE4’-morpholino-acetophenon4''-MORPHOLIONOACETOPHENONE4-Morpholinoacetophenone,99%

1-(4-Morpholinophenyl)ethanoneEthanone, 1-[4-(4-morpholinyl)phenyl]-1-(4-morpholin-4-ylphenyl)ethanoneMFCD000061681-[4-(morpholin-4-yl)phenyl]ethan-1-one4 inverted exclamation mark -Morpholinoacetophenone1-(4-Morpholin-4-yl-phenyl)-ethanone1-(4-morpholinophenyl)ethan-1-one

Database identifiers

CAS: 39910-98-0
PubChem CID: 38362
DTXSID: DTXSID30192967
UNII: VJ32JDU2T4
EC Number: 254-698-9
Nikkaji: J33.807I

Properties

Computed structural properties

XLogP: 1
Topological polar surface area: 29.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 15
Formal charge: 0
Complexity: 216

Physicochemical properties

Melting point: 96 · 96-98 °C(lit.)
Boiling point: 343.93 °C · 343.93°C (rough estimate)
Density: 1.0958 · 1.0958 (rough estimate)
refractive index: 1.516 · 1.5160 (estimate)
storage temp.: Sealed in dry,Room Temperature
pka: 2.23 · 2.23±0.40(Predicted)
form: Crystalline Powder
color: Yellow to light brown
InChI: 1S/C12H15NO2/c1-10(14)11-2-4-12(5-3-11)13-6-8-15-9-7-13/h2-5H,6-9H2,1H3
InChIKey: AKQWEDMTPCAESO-UHFFFAOYSA-N
SMILES: CC(=O)c1ccc(cc1)N2CCOCC2
FDA UNII: 32 JDU2T4 · VJ32JDU2T4
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338
target organs: Respiratory system
PPE: 95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-37/39
WGK Germany: 3 · 3
RTECS: 9486200 · AM9486200
HS Code: 29349990 · 29349990
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
Toxicity: 50 · mouse,LD50,intravenous,56mg/kg (56mg/kg),U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04795,

Safety & regulation

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 40 reports by companies from 3 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

PPE: dust mask type N95 (US), Eyeshields, Gloves
wgk: 3
rtecs: AM9486200
hs_code: 29349990
Toxicity: mouse,LD50,intravenous,56mg/kg (56mg/kg),U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04795,
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-37/39
Storage Class: 11 - Combustible Solids
target organs: Respiratory system
Hazard statements: H315-H319-H335
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements: P261-P305+P351+P338

Chemistry & industry

Applications

Uses4′-Morpholinoacetophenone undergoes ruthenium catalyzed step-growth copolymerization with 1,3-divinyltetramethyldisiloxane to give high molecular weight copolymers.

General Description4′-Morpholinoacetophenone undergoes ruthenium catalyzed step-growth copolymerization with 1,3-divinyltetramethyldisiloxane to give high molecular weight copolymers.