ChemicalBook--->CAS DataBase List--->4984-85-4

4984-85-4

4984-85-4 Structure

4984-85-4 Structure
IdentificationMore
[Name]

PROPIOIN
[CAS]

4984-85-4
[Synonyms]

PROPIOIN
Propyroin
NSC 23087
PROPIONOIN
Propioin>
Propionoine
TIMTEC-BB SBB008173
4-Hydroxyhexan-3-on
4-hydroxyhexan-3-one
3-Hydroxy-4-hexanone
4-HYDROXY-3-HEXANONE
4-Hydroxyhexane-3-one
3-Hexanone, 4-hydroxy-
(4R)-4-hydroxy-3-hexanone
Ethyl alpha-hydroxypropyl ketone
[EINECS(EC#)]

225-637-3
[Molecular Formula]

C6H12O2
[MDL Number]

MFCD00043572
[Molecular Weight]

116.16
[MOL File]

4984-85-4.mol
Chemical PropertiesBack Directory
[Melting point ]

-3.75°C (estimate)
[Boiling point ]

167 °C
[density ]

0,95 g/cm3
[refractive index ]

1.4340 (589.3 nm 21℃)
[Fp ]

54 °C
[form ]

clear liquid
[pka]

13.03±0.20(Predicted)
[color ]

White to Yellow to Green
[InChI]

1S/C6H12O2/c1-3-5(7)6(8)4-2/h5,7H,3-4H2,1-2H3
[InChIKey]

SKCYVGUCBRYGTE-UHFFFAOYSA-N
[SMILES]

CCC(O)C(=O)CC
[LogP]

0.720 (est)
[CAS DataBase Reference]

4984-85-4(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

UN 1993C 3 / PGIII
[WGK Germany ]

WGK 3
[HS Code ]

2914.40.9000
[HazardClass ]

3
[PackingGroup ]

III
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Flam. Liq. 3
Hazard InformationBack Directory
[Uses]

Propioin is a useful research chemical used in the preparation of simple acyloins and benzoins.
[Definition]

ChEBI: 4-hydroxyhexan-3-one is a hexanone that is hexan-3-one substituted by a hydroxy group at position 4. It is a secondary alcohol, a secondary alpha-hydroxy ketone and a hexanone.
Spectrum DetailBack Directory
[Spectrum Detail]

PROPIOIN(4984-85-4)MS
PROPIOIN(4984-85-4)1HNMR
PROPIOIN(4984-85-4)13CNMR
PROPIOIN(4984-85-4)IR1
PROPIOIN(4984-85-4)Raman
Well-known Reagent Company Product InformationBack Directory
[TCI AMERICA]

Propioin,>95.0%(GC)(4984-85-4)
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