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Merck
CN

V800075

Benzoic acid

≥99%, crystalline, suitable for analytical testing, Vetec™

Synonym(s):

Benzenecarboxylic acid, Carboxybenzene

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About This Item

Linear Formula:
C6H5COOH
CAS Number:
65-85-0
Molecular Weight:
122.12
UNSPSC Code:
12352300
PubChem Substance ID:
329829135
EC Number:
200-618-2
Beilstein/REAXYS Number:
636131
MDL number:
MFCD00002398
Assay:
≥99%
Form:
crystalline

Key Documents

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Product Name

Benzoic acid, AR, ≥99%

InChI key

WPYMKLBDIGXBTP-UHFFFAOYSA-N

InChI

1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)

SMILES string

OC(=O)c1ccccc1

grade

AR

vapor density

4.21 (vs air)

vapor pressure

10 mmHg ( 132 °C)

product line

Vetec™

assay

≥99%

form

crystalline

autoignition temp.

1061 °F

bp

249 °C (lit.)

mp

121-125 °C (lit.)

solubility

water: 2.9 g/L at 25 °C

density

1.32 g/cm3 at 20 °C

functional group

carboxylic acid, phenyl

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Legal Information

Vetec is a trademark of Merck KGaA, Darmstadt, Germany

pictograms

Health hazardCorrosion
GHS08,GHS05

signalword

Danger

Hazard Classifications

Eye Dam. 1 - Skin Irrit. 2 - STOT RE 1 Inhalation

target_organs

Lungs

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk

WGK 1

flash_point_f

249.8 °F - closed cup

flash_point_c

121 °C - closed cup

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
BGBC2172
BGBC1386
BGBB9754

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S Nacht et al.
Journal of the American Academy of Dermatology, 4(1), 31-37 (1981-01-01)
The transepidermal penetration and metabolic disposition of 14C-benzoyl peroxide were assessed in vitro (excised human skin) and in vivo (rhesus monkey). In vitro, the benzoyl peroxide penetrated into the skin, through the stratum corneum or the follicular openings, or both
Renbo Wei et al.
Macromolecular rapid communications, 34(4), 330-334 (2013-01-03)
A new approach is developed to fabricate highly oriented mono-domain LCE nano/microstructures through micro-molding in capillaries. Gratings and microwires as two typical examples are fabricated and characterized by polarizing optical microscopy, optical microscopy, and scanning electron microscopy. The gratings with
G C Tremblay et al.
Pharmacology & therapeutics, 60(1), 63-90 (1993-10-01)
Detoxification of sodium benzoate by elimination as a conjugate with glycine, a nonessential amino acid, provides a pathway for the disposal of waste nitrogen. Since 1979, sodium benzoate has been widely used in the therapeutic regimen to combat ammonia toxicity
Wanchun Xiang et al.
ChemSusChem, 6(2), 256-260 (2013-01-25)
Sensing the sun: Incorporation of a cyanomethyl benzoic acid electron acceptor into donor-π-acceptor sensitizers for dye-sensitized-solar cell is shown to lead to devices with improved conversion efficiency when compared with more widely used cyanoacetic acid acceptor.
Copper-mediated C-H/C-H biaryl coupling of benzoic acid derivatives and 1,3-azoles.
Mayuko Nishino et al.
Angewandte Chemie (International ed. in English), 52(16), 4457-4461 (2013-03-21)
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