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603122-80-1

603122-80-1 Structure

603122-80-1 Structure
IdentificationBack Directory
[Name]

Methyl 4-borono-3-chlorobenzoate
[CAS]

603122-80-1
[Synonyms]

METHYL 4-BORONO-3-CHLOROBENZOATE
2-CHLORO-4-(METHOXYCARBONYL)PHENYLBORONIC ACID
2-CHLORO-4-(METHOXYCARBONYL)BENZENEBORONIC ACID
Benzoic acid, 4-borono-3-chloro-, 1-methyl ester
2-CHLORO-4-(METHOXYCARBONYL)BENZENEBORONIC ACID 98
2-Chloro-4-(methoxycarbonyl)benzeneboronic acid 98%
2-Chloro-4-(methoxycarbonyl)phenylboronic Acid (contains varying amounts of Anhydride)
[Molecular Formula]

C8H8BClO4
[MDL Number]

MFCD08689530
[MOL File]

603122-80-1.mol
[Molecular Weight]

214.41
Chemical PropertiesBack Directory
[Melting point ]

140-142
[Boiling point ]

386.6±52.0 °C(Predicted)
[density ]

1.39±0.1 g/cm3(Predicted)
[storage temp. ]

Keep Cold
[solubility ]

soluble in Methanol
[form ]

powder to crystal
[pka]

7.40±0.58(Predicted)
[color ]

White to Almost white
[InChI]

InChI=1S/C8H8BClO4/c1-14-8(11)5-2-3-6(9(12)13)7(10)4-5/h2-4,12-13H,1H3
[InChIKey]

ITEQHBSWRMYSRP-UHFFFAOYSA-N
[SMILES]

C(OC)(=O)C1=CC=C(B(O)O)C(Cl)=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

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

Xi
[Hazard Note ]

Irritant/Keep Cold
[HS Code ]

2931900090
Spectrum DetailBack Directory
[Spectrum Detail]

Methyl 4-borono-3-chlorobenzoate(603122-80-1)1HNMR
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