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1.00134

Benzoic acid

standard for elemental analysis

别名:

Benzoic acid, Phenylformic acid, Benzene carboxylic acid

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关于此项目

经验公式（希尔记法）:
C7H6O2
化学文摘社编号:
65-85-0
分子量:
122.12
MDL number:
MFCD00002398
UNSPSC Code:
12352106
EC Index Number:
200-618-2
NACRES:
NA.21
Form:
solid
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vapor pressure

0.001 hPa ( 20 °C)

Quality Level

100

form

solid

autoignition temp.

570 °C

potency

1700 mg/kg LD50, oral (Rat), >5000 mg/kg LD50, skin (Rabbit)

pH

2.5-3.5 (20 °C in H2O, saturated solution)

bp

249 °C/1013 hPa

mp

121-123 °C

transition temp

flash point 121 °C

density

1.321 g/cm3 at 20 °C

bulk density

500 kg/m3

storage temp.

2-30°C

SMILES string

[O-]C(=O)c1ccccc1.[H+]

InChI

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

InChI key

WPYMKLBDIGXBTP-UHFFFAOYSA-N

Application


  • A familiar ring to it: biosynthesis of plant benzoic acids - This study explores the biosynthetic pathways leading to benzoic acid in plants, important for understanding plant metabolism and engineering synthetic pathways for production of benzoic acid derivatives (Widhalm and Dudareva, 2015).

  • Pd (II)-catalysed meta-C-H functionalizations of benzoic acid derivatives - Describes a method for the meta-C-H functionalization of benzoic acid derivatives, which could be pivotal for synthetic chemistry applications (Li et al., 2016).

Analysis Note

C (Carbon): 68.8
H (Hydrogen):  5.0
O (Oxygen): 26.2
Suitable for determination of C, H, O

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pictograms

CorrosionHealth hazard
GHS05,GHS08

signalword

Danger

Hazard Classifications

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

target_organs

Lungs

存储类别

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

wgk

WGK 1

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全球贸易项目编号

货号GTIN
100134000504022536002293