2-[(Cyclopropylamino)methyl]phenol is an organic compound characterized by the presence of a cyclopropylamino group attached to a methyl group, which is in turn connected to a phenol moiety. This unique structure endows it with specific chemical properties that make it a valuable intermediate in various chemical reactions.

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Basic information
1. Product Name: 2-[(cyclopropylamino)methyl]phenol
2. Synonyms: 2-[(cyclopropylamino)methyl]phenol
3. CAS NO:643007-91-4
4. Molecular Formula: C10H13NO
5. Molecular Weight: 163.21632
6. EINECS: N/A
7. Product Categories: N/A
8. Mol File: 643007-91-4.mol
Chemical Properties
1. Melting Point: 175-176 °C(Solv: ethanol (64-17-5))
2. Boiling Point: 286.6±15.0 °C(Predicted)
3. Flash Point: N/A
4. Appearance: /
5. Density: 1.14±0.1 g/cm3(Predicted)
6. Refractive Index: N/A
7. Storage Temp.: N/A
8. Solubility: N/A
9. PKA: 10.04±0.30(Predicted)
10. CAS DataBase Reference: 2-[(cyclopropylamino)methyl]phenol(CAS DataBase Reference)
11. NIST Chemistry Reference: 2-[(cyclopropylamino)methyl]phenol(643007-91-4)
12. EPA Substance Registry System: 2-[(cyclopropylamino)methyl]phenol(643007-91-4)
Safety Data
1. Hazard Codes: N/A
2. Statements: N/A
3. Safety Statements: N/A
4. WGK Germany:
5. RTECS:
6. HazardClass: N/A
7. PackingGroup: N/A
8. Hazardous Substances Data: 643007-91-4(Hazardous Substances Data)

643007-91-4 Usage

Uses

Used in Pharmaceutical Industry:
2-[(Cyclopropylamino)methyl]phenol is used as a key intermediate in the synthesis of C-aryl-N-cyclopropylnitrones. These nitrones are important in the development of pharmaceutical compounds, particularly as potential therapeutic agents with diverse biological activities, such as antioxidant, anti-inflammatory, and neuroprotective properties.
Used in Chemical Research:
In the field of chemical research, 2-[(cyclopropylamino)methyl]phenol serves as a valuable reagent for the synthesis of various organic compounds, including C-aryl-N-cyclopropylnitrones. Its unique structure allows for the exploration of new synthetic pathways and the development of innovative chemical processes.
Used in Material Science:
2-[(Cyclopropylamino)methyl]phenol can also be utilized in material science for the development of novel materials with specific properties. Its incorporation into polymers or other materials can lead to the creation of new composites with improved characteristics, such as enhanced stability, reactivity, or selectivity in various applications.

Check Digit Verification of cas no

The CAS Registry Mumber 643007-91-4 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 6,4,3,0,0 and 7 respectively; the second part has 2 digits, 9 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 643007-91:
(8*6)+(7*4)+(6*3)+(5*0)+(4*0)+(3*7)+(2*9)+(1*1)=134
134 % 10 = 4
So 643007-91-4 is a valid CAS Registry Number.

643007-91-4Upstream product

643007-91-4Downstream Products

643007-91-4Relevant articles and documents

Synthesis and spectroscopic characterization of Ni(II) complexes involving functionalised dithiocarbamates and triphenylphosphine: Anagostic interaction in (N-cyclopropyl-N-(4-fluorobenzyl)dithiocarbamato-S,S′) (thiocyanato-N)(triphenylphosphine)nickel(II)

Sathiyaraj,Srinivasan,Thirumaran,Velmurugan

, p. 203 - 209 (2015/09/22)

Twelve new nickel(II) complexes namely [Ni(S2CNRR′)2](1-6) and [Ni(S2CNRR′)(NCS)(PPh3)](7-12) [where R = cyclopropyl (cPr); R′ = 2HO-C6H4-CH2- (1,7), 3HO-C6H4-CH2- (2,8), 4HO-C6H4-CH2- (3,9), 4CH3O-C6H4-CH2- (4,10), 4F-C6H4-CH2- (5,11), 4Cl-C6H4-CH2- (6,12)] have been prepared and characterized by elemental analysis, IR, UV-Vis and NMR (1H and 13C) spectroscopy. A single crystal X-ray structural analysis was carried out for (N-cyclopropyl-N-(4-fluorobenzyl)dithiocarbamato-S,S′)(thiocyanato-N)- (triphenylphosphine)nickel(II). The increase in wavenumber of νC-N thioureide and decrease in chemical shift values of heteroleptic complexes 7-12 compared to that of homoleptic complexes 1-6 are due to the mesomeric drift of electron density from the dithiocarbamate moiety towards the metal centre, increasing the carbon-nitrogen double bond character. The increased strength of C-N bond is due to the presence of the π-accepting triphenylphosphine. Electronic spectral studies indicated square planar geometry around the nickel(II) central atom for all the complexes. Single crystal X-ray structural analysis of 11 confirms that the coordination geometry about the Ni is distorted square planar. The C-H...F interactions lead to a polymeric structure and a rare intramolecular anagostic interaction [M…H = 2.929 ?] is observed. The molecular geometry, HOMO-LUMO in the ground state and MEP have been calculated for 11 using the Hartree-Fock (HF) method with the LANL2DZ basic set. The optimized bond lengths and bond angles agree well with the experimental results. The asymmetry in the Ni-S bonds reveal the greater trans influence of triphenylphosphine compared to that of the isothiocyanate ion.

Synthesis of C-aryl-N-cyclopropylnitrones

Vukics, Krisztina,Tarkanyi, Gabor,Dravecz, Ferenc,Fischer, Janos

, p. 3419 - 3425 (2007/10/03)

Synthesis of C-aryl-N-cyclopropylnitrones is described. Preparations were performed either by condensation of the appropriate aldehyde with N-cyclopropyl-hydroxylamine, or oxidation of N-substituted N-cyclopropylamines with sodium tungstate/hydrogen perox

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643007-91-4