ChemicalBook--->CAS DataBase List--->701-97-3

701-97-3

701-97-3 Structure

701-97-3 Structure
IdentificationMore
[Name]

Cyclohexanepropionic acid
[CAS]

701-97-3
[Synonyms]

3-CYCLOHEXANEPROPIONIC ACID
3-CYCLOHEXYLPROPIONIC ACID
CYCLOHEXANEPROPIONIC ACID
CYCLOHEXYL PROPIONIC ACID
3-Cyclohexylpropanoic acid
beta-Cyclohexylpropionic acid
cyclohexanepropanoicacid
3-Cyclohexanepropanoic Acid
3-Cyclohexylpropionic acid, 98+%
Cyclohexanepropionic acid, 99+%
CYCLOHEXANEPROPIONIC ACID (3-CYCLOHEXYLPROPIONIC ACID)
3-CYCLOHEXYLPROPIONIC ACID 99+%
[EINECS(EC#)]

211-861-9
[Molecular Formula]

C9H16O2
[MDL Number]

MFCD00001527
[Molecular Weight]

156.22
[MOL File]

701-97-3.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless to slightly yellow liquid
[Melting point ]

14-17 °C (lit.)
[Boiling point ]

275.8 °C (lit.)
[density ]

0.912 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.464(lit.)
[Fp ]

>230 °F
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

Chloroform (Sparingly), Methanol (Slightly)
[form ]

Liquid
[pka]

pK1:4.91 (25°C)
[color ]

Clear colorless to slightly yellow
[Water Solubility ]

insoluble
[Detection Methods]

GC,NMR
[BRN ]

2042799
[InChI]

1S/C9H16O2/c10-9(11)7-6-8-4-2-1-3-5-8/h8H,1-7H2,(H,10,11)
[InChIKey]

HJZLEGIHUQOJBA-UHFFFAOYSA-N
[SMILES]

OC(=O)CCC1CCCCC1
[LogP]

2.669 (est)
[CAS DataBase Reference]

701-97-3(CAS DataBase Reference)
[NIST Chemistry Reference]

Cyclohexanepropanoic acid(701-97-3)
[EPA Substance Registry System]

701-97-3(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319
[Precautionary statements ]

P264-P270-P280-P301+P312-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R22:Harmful 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 .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
[TSCA ]

Yes
[REACH Registrations]

Active
[HS Code ]

29162000
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
Raw materials And Preparation ProductsBack Directory
[Raw materials]

4-hydroxyCyclohexanepropanoic acid-->3-Cyclohexyl-1-propanol-->(1-Bromoethyl)-cyclohexane-->4-oxoCyclohexanepropanoic acid-->4-Hydroxycinnamic acid-->Cyclohexylacetylene-->Vinylcyclohexane-->cyclohexanepropionaldehyde-->Cinnamaldehyde-->Formic acid-->Carbon dioxide-->Bromocyclohexane
[Preparation Products]

Allyl cyclohexylpropionate-->Ethyl cyclohexanepropionate-->2-Cyclohexyl-ethylamine hydrochloride
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3-Cyclohexylpropionic acid(701-97-3).msds
Hazard InformationBack Directory
[Chemical Properties]

clear colorless to slightly yellow liquid
[Uses]

3-Cyclohexylpropionic acid can be used to produce 3-cyclohexyl-propionyl chloride. It is used as pharmaceutical intermediates in organic synthesis. It can also be used for the synthesis of pineapple esters.
[Biochem/physiol Actions]

3-Cyclohexanepropionic acid facilitates oral delivery of cromolyn via permeation across/through the membrane in rats.
Spectrum DetailBack Directory
[Spectrum Detail]

Cyclohexanepropionic acid(701-97-3)MS
Cyclohexanepropionic acid(701-97-3)1HNMR
Cyclohexanepropionic acid(701-97-3)IR1
Cyclohexanepropionic acid(701-97-3)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Cyclohexanepropionic acid, 99+%(701-97-3)
[Alfa Aesar]

3-Cyclohexylpropionic acid, 98+%(701-97-3)
[Sigma Aldrich]

701-97-3(sigmaaldrich)
[TCI AMERICA]

Cyclohexanepropionic Acid,>99.0%(GC)(701-97-3)
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