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1145681-01-1

1145681-01-1 Structure

1145681-01-1 Structure
IdentificationBack Directory
[Name]

1-(4-chlorophenyl)-3-hydroxycyclobutanecarboxylic acid
[CAS]

1145681-01-1
[Synonyms]

1-(4-chlorophenyl)-3-hydroxycyclobutanecarboxylic acid
trans-1-(4-Chlorophenyl)-3-hydroxycyclobutanecarboxylic acid
(1S,3S)-1-(4-chlorophenyl)-3-hydroxycyclobutanecarboxylic acid
Cyclobutanecarboxylic acid, 1-(4-chlorophenyl)-3-hydroxy-, trans-
[Molecular Formula]

C11H11ClO3
[MDL Number]

MFCD20524881
[MOL File]

1145681-01-1.mol
[Molecular Weight]

226.66
Chemical PropertiesBack Directory
[Boiling point ]

409.889±45.00 °C(Press: 760.00 Torr)(predicted)
[density ]

1.464±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
[form ]

solid
[pka]

4.002±0.40(predicted)
[InChI]

1S/C11H11ClO3/c12-8-3-1-7(2-4-8)11(10(14)15)5-9(13)6-11/h1-4,9,13H,5-6H2,(H,14,15)
[InChIKey]

PQVUQOBVSQOFKH-UHFFFAOYSA-N
[SMILES]

OC1CC(C1)(C(O)=O)c2ccc(Cl)cc2
Safety DataBack Directory
[WGK Germany ]

WGK 3
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
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