ChemicalBook--->CAS DataBase List--->31719-77-4

31719-77-4

31719-77-4 Structure

31719-77-4 Structure
IdentificationMore
[Name]

3-(Chloromethyl)benzoic acid
[CAS]

31719-77-4
[Synonyms]

3-(CHLOROMETHYL)BENZOIC ACID
ALPHA-CHLORO-M-TOLUIC ACID
3-(Chloromethyl)Benzoic
α-chloro-m-toluic acid
3-(CHLOROMETHYL) BENZOIC ACID 98%
m-Chloromethylbenzoic acid
[EINECS(EC#)]

627-977-1
[Molecular Formula]

C8H7ClO2
[MDL Number]

MFCD00191922
[Molecular Weight]

170.59
[MOL File]

31719-77-4.mol
Chemical PropertiesBack Directory
[Melting point ]

136-138 °C (lit.)
[Boiling point ]

327.2±25.0 °C(Predicted)
[density ]

1.315±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,2-8°C
[solubility ]

methanol: 20 mg/mL, clear
[pka]

4.09±0.10(Predicted)
[BRN ]

637114
[CAS DataBase Reference]

31719-77-4(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi,C
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R34:Causes burns.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

UN 2811 6.1/PG 3
[WGK Germany ]

3
[F ]

19
[HazardClass ]

8
[PackingGroup ]

Hazard InformationBack Directory
[Uses]

3-(Chloromethyl)benzoic acid is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuff fields.
[General Description]

3-(Chloromethyl)benzoic acid (m-Chloromethylbenzoic acid) is a meta-substituted benzoic acid derivative. Correlations between Hammett substituent constants and calculated dipole moments and molecular transform and normalized molecular moment structure indices for m-chloromethylbenzoic acid was investigated. Hammett constants were observed to be linearly related only to the normalized charge moment index.
Spectrum DetailBack Directory
[Spectrum Detail]

3-(Chloromethyl)benzoic acid(31719-77-4)IR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

31719-77-4(sigmaaldrich)
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