Carvone oxime

Base Information

• Chemical Name: Carvone oxime
• CAS No.: 31198-76-2
• Deprecated CAS: 36065-14-2
• Molecular Formula: C10H15 N O
• Molecular Weight: 165.235
• European Community (EC) Number: 250-510-4
• NSC Number: 97240
• Nikkaji Number: J24.275F
• Mol file: 31198-76-2.mol

Synonyms:Carvone oxime;31198-76-2;p-Mentha-1(6),8-dien-2-one oxime;1,8-p-Menthadienyl-6-oxime;p-Mentha-6,8-dien-2-one, oxime;EINECS 250-510-4;NSC 97240;5-Isopropenyl-2-methyl-cyclohex-2-enone oxime;Carvoxime;2051-55-0;2-Cyclohexen-1-one, 2-methyl-5-(1-methylethenyl)-, oxime;p-Mentha-6, oxime;SCHEMBL7183180;NSC97240;NSC-97240;5-Isopropenyl-2-methylcyclohex-2-enone oxime;5-Isopropenyl-2-methyl-2-cyclohexen-1-one, oxime;5-isopropenyl-2-methyl-cyclohex-2-en-1-one oxime

Chemical Property of Carvone oxime

Chemical Property:

• Vapor Pressure: 0.0005mmHg at 25°C
• Melting Point: 92-93 °C
• Boiling Point: 279°Cat760mmHg
• PKA: 11.88±0.60(Predicted)
• Flash Point: 164.1°C
• PSA: 32.59000
• Density: 1g/cm³
• LogP: 2.74900
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 165.115364102
• Heavy Atom Count: 12
• Complexity: 251

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CCC(CC1=NO)C(=C)C
• Isomeric SMILES: CC\1=CCC(C/C1=N/O)C(=C)C

Technology Process of Carvone oxime

There total 28 articles about Carvone oxime which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 89.0%

Carvone (99-49-0,22327-39-5) → carvoxime (31198-76-2)

Guidance literature:

With hydroxylamine hydrochloride; sodium acetate; In methanol; water; at 60 ℃;

DOI:10.1021/jo9812429

Reference yield:

p-mentha-6,8-dien-2-one-[O-(2-nitro-benzoyl)-oxime ] + furan-2,3,5(4H)-trione pyridine (1:1) → ortho-nitrobenzoic acid (552-16-9,104810-18-6) + (S)-p-mentha-6,8-dien-2-one-(Z)-oxime (2051-55-0,26127-86-6,31198-76-2,33012-78-1,36065-14-2,55658-55-4,60827-56-7,65877-16-9,80124-30-7)

Guidance literature:

2-nitro benzoate of d-carvoxime;

Reference yield:

p-mentha-6,8-dien-2-one-[O-(4-nitro-benzoyl)-oxime ] + furan-2,3,5(4H)-trione pyridine (1:1) → (S)-p-mentha-6,8-dien-2-one-(Z)-oxime (2051-55-0,26127-86-6,31198-76-2,33012-78-1,36065-14-2,55658-55-4,60827-56-7,65877-16-9,80124-30-7) + 4-nitro-benzoic acid (62-23-7)

Guidance literature:

4-nitro benzoate of d-carvoxime;

upstream raw materials:

(S)-p-mentha-6,8-dien-2-one

Carvone

(R)-p-mentha-6,8-dien-2-one-(Z)-oxime

(S)-p-mentha-6,8-dien-2-one-(Z)-oxime

Downstream raw materials:

2-methyl-5-(prop-1-en-2-yl)cyclohexanone

8-chloro-p-menth-6-en-2-one oxime

carvomenthone

5-isopropyl-2-methylphenylamine

Refernces

• 1、 Hutchins, Robert O.,Rao, Samala J.,Adams, Jeffrey,Hutchins, Marygail K.. "Stereoselective hydride reductions of cyclic α,β-unsaturated n-diphenylphosphinyl imines to protected allylic amines". . p. 8077 - 8080. Retrieved 2007/10/03.