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1774-12-5

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1774-12-5 Structure

1774-12-5 Structure
IdentificationBack Directory
[Name]

5-(4-METHOXY-PHENYL)-CYCLOHEXANE-1,3-DIONE
[CAS]

1774-12-5
[Synonyms]

ASISCHEM C66302
RARECHEM AR PA 0046
4-(3,5-Dioxocyclohexyl)anisole
5-(p-Methoxyphenyl)-1,3-cyclohexanedione
1,3-Cyclohexanedione, 5-(4-Methoxyphenyl)-
5-(4-methoxyphenyl)cyclohexane-1,3-quinone
5-(4-METHOXY-PHENYL)-CYCLOHEXANE-1,3-DIONE
5-[4-(METHOXY)PHENYL]-1,3-CYCLOHEXANEDIONE
5-(4-METHOXYPHENYL)-CYCLOHEXANE-1,3-DIONE 97%
5-[4-(Methoxyphenyl)]-1,3-cyclohexanedione 96%
[Molecular Formula]

C13H14O3
[MDL Number]

MFCD00104791
[MOL File]

1774-12-5.mol
[Molecular Weight]

218.25
Chemical PropertiesBack Directory
[Melting point ]

179.5-183.5 °C(lit.)
[Boiling point ]

394.4±42.0 °C(Predicted)
[density ]

1.163±0.06 g/cm3(Predicted)
[storage temp. ]

Storage temp. 2-8°C
[pka]

4.95±0.20(Predicted)
[Appearance]

White to light yellow Solid
[InChI]

1S/C13H14O3/c1-16-13-4-2-9(3-5-13)10-6-11(14)8-12(15)7-10/h2-5,10H,6-8H2,1H3
[InChIKey]

AHYCBDWPHFFKFK-UHFFFAOYSA-N
[SMILES]

COc1ccc(cc1)C2CC(=O)CC(=O)C2
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)Flame (GHS02)
GHS07,GHS02
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H226
[Precautionary statements ]

P501-P270-P240-P210-P233-P243-P241-P242-P264-P280-P370+P378-P337+P313-P305+P351+P338-P362+P364-P303+P361+P353-P332+P313-P301+P312+P330-P403+P235
[WGK Germany ]

3
[HazardClass ]

IRRITANT
[HS Code ]

2914500090
[Storage Class]

11 - Combustible Solids
Spectrum DetailBack Directory
[Spectrum Detail]

5-(4-METHOXY-PHENYL)-CYCLOHEXANE-1,3-DIONE(1774-12-5)1HNMR
5-(4-METHOXY-PHENYL)-CYCLOHEXANE-1,3-DIONE(1774-12-5)IR
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