ChemicalBook--->CAS DataBase List--->611-95-0

611-95-0

611-95-0 Structure

611-95-0 Structure
IdentificationMore
[Name]

4-BROMOBENZHYDROL
[CAS]

611-95-0
[Synonyms]

4-BENZOYLBENZOIC ACID
(+/-)-4-BROMOBENZHYDROL
4-BROMOBENZHYDROL
4-CARBOXY BENZOPHENONE
BENZOPHENONE-4-CARBOXYLIC ACID
LABOTEST-BB LT00159467
P-BENZOYLBENZOIC ACID
P-BROMOBENZHYDROL
RARECHEM AL BO 0331
Benzophenone-4-carboxylic acid~4-Carboxybenzophenone
Benzoylbenzoicacid
Benzoic acid, 4-benzoyl-
benzophenonecarboxylic acid
PARA-BENZOYLBENZOICACID
4-BENZOYLBENZOIC ACID 99%
[EINECS(EC#)]

210-286-0
[Molecular Formula]

C13H11BrO
[MDL Number]

MFCD00016851
[Molecular Weight]

263.13
[MOL File]

611-95-0.mol
Chemical PropertiesBack Directory
[Appearance]

white crystalline solid
[Melting point ]

198-200 °C (lit.)
[Boiling point ]

327.84°C (rough estimate)
[density ]

1.2022 (rough estimate)
[refractive index ]

1.5767 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

Crystalline Powder
[pka]

3.79±0.10(Predicted)
[color ]

White to light beige
[Stability:]

Stable. Incompatible with strong bases, strong oxidizing agents.
[Water Solubility ]

It is soluble in water (partly).
[BRN ]

1960224
[InChI]

InChI=1S/C14H10O3/c15-13(10-4-2-1-3-5-10)11-6-8-12(9-7-11)14(16)17/h1-9H,(H,16,17)
[InChIKey]

IFQUPKAISSPFTE-UHFFFAOYSA-N
[SMILES]

C(O)(=O)C1=CC=C(C(=O)C2=CC=CC=C2)C=C1
[CAS DataBase Reference]

611-95-0(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P280g-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

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

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
[RTECS ]

DG3650000
[Hazard Note ]

Irritant
[HS Code ]

29145090
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Hazard]

A poison.
[Chemical Properties]

white crystalline solid
[Uses]

4-Benzoylbenzoic acid,is a important organic intermediate. It can be used in agrochemical, pharmaceutical and dyestuff field etc.
[General Description]

4-Benzoylbenzoic acid is a benzophenone derivative. It can undergo hydrogenolysis to 4-benzylbenzoic acid. Cotton fabrics incorporated with 4-benzoylbenzoic acid have shown pesticide degradation ability, when exposed to UV irradiation.
[Safety Profile]

A poison by intravenous route.When heated to decomposition it emits acrid smoke andirritating vapors.
[Purification Methods]

Dissolve the acid in hot H2O by adding enough aqueous KOH solution till distinctly alkaline, filter and then acidify with drops of conc HCl. Filter off, wash the solid with cold H2O, dry it at 100o, and recrystallise it from EtOH. [Wertheim J Am Chem Soc 55 2540 1933, Beilstein 10 H 753, 10 IV 3305.]
Spectrum DetailBack Directory
[Spectrum Detail]

4-BROMOBENZHYDROL(611-95-0)MS
4-BROMOBENZHYDROL(611-95-0)1HNMR
4-BROMOBENZHYDROL(611-95-0)13CNMR
4-BROMOBENZHYDROL(611-95-0)IR1
4-BROMOBENZHYDROL(611-95-0)IR2
4-BROMOBENZHYDROL(611-95-0)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-Benzoylbenzoic acid, 99%(611-95-0)
[Alfa Aesar]

4-Benzoylbenzoic acid, 99%(611-95-0)
[Sigma Aldrich]

611-95-0(sigmaaldrich)
[TCI AMERICA]

4-Benzoylbenzoic Acid,>98.0%(T)(611-95-0)
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