Bicyclo(2.2.1)heptane-2,3-dione, 1,7,7-trimethyl-, 3-oxime

Base Information

• Chemical Name: Bicyclo(2.2.1)heptane-2,3-dione, 1,7,7-trimethyl-, 3-oxime
• CAS No.: 663-17-2
• Molecular Formula: C10H15 N O2
• Molecular Weight: 181.235
• European Community (EC) Number: 636-268-6
• NSC Number: 176914,3157
• Nikkaji Number: J2.729.433B
• Mol file: 663-17-2.mol

Synonyms:663-17-2;Bicyclo(2.2.1)heptane-2,3-dione, 1,7,7-trimethyl-, 3-oxime;Bicyclo[2.2.1]heptane-2,3-dione, 1,7,7-trimethyl-, 3-oxime;(1R,E)-(+)-Camphorquinone 3-oxime;31571-14-9;MLS002637669;NSC3157;anti-(1R)-(+)-Camphorquinone 3-oxime;SCHEMBL9360526;YRNPDSREMSMKIY-XFFZJAGNSA-N;NSC-3157;UPCMLD00NBDS-3-4:001;NSC176914;STK965343;AKOS002286176;NSC 176914;NSC-176914;NCGC00165387-01;anti-(1R)-(+)-2,3-Bornanedione 3-Oxime;C1661;CS-0450929;(3Z)-1,7,7-Trimethylbicyclo[2.2.1]heptane-2,3-dione 3-oxime #;(3Z)-3-(hydroxyimino)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one;(E)-3-(Hydroxyimino)-1,7,7-trimethylbicyclo[2.2.1]heptane-2-one;(Z)-3-(hydroxyimino)-1,7,7-trimethylbicyclo[2.2.1]Heptan-2-one;4,7,7-Trimethylbicyclo[2.2.1]heptan-2,3-dione, 2-oxime (syn)

Chemical Property of Bicyclo(2.2.1)heptane-2,3-dione, 1,7,7-trimethyl-, 3-oxime

Chemical Property:

• Melting Point: 154-156 °C(lit.)
• Boiling Point: 276.8oC at 760 mmHg
• Flash Point: 121.2oC
• PSA: 49.66000
• Density: 1.25g/cm3
• LogP: 1.84180
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 181.110278721
• Heavy Atom Count: 13
• Complexity: 306

Purity/Quality:

90%,98% ^*data from raw suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 22-43
• Safety Statements: 36/37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(C2CCC1(C(=O)C2=NO)C)C
• Isomeric SMILES: CC1(C\2CCC1(C(=O)/C2=N\O)C)C

Technology Process of Bicyclo(2.2.1)heptane-2,3-dione, 1,7,7-trimethyl-, 3-oxime

There total 2 articles about Bicyclo(2.2.1)heptane-2,3-dione, 1,7,7-trimethyl-, 3-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:

ethanol (64-17-5) + 3-(4-oxy-phenylimino)-camphor (872820-67-2) + water (7732-18-5) + sodium acetate (127-09-3) → 4-amino-phenol (123-30-8) + (1R,4S)-3-hydroxyimino-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one (663-17-2,5338-41-0,13854-86-9,13854-87-0,22472-58-8,31571-14-9,103833-77-8)

Guidance literature:

3-<4-oxy-phenylimino>-d-camphor;

Reference yield:

3-(4-ethoxy-anilino)-3-hydroxylamino-camphor → (1R,4S)-3-hydroxyimino-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one (663-17-2,5338-41-0,13854-86-9,13854-87-0,22472-58-8,31571-14-9,103833-77-8) + 4-Ethoxyaniline (156-43-4)

Guidance literature:

3-<4-ethoxy-anilino>-3-hydroxylamino-d-camphor;

Reference yield: 98.0%

camphorquinone monooxime (663-17-2) → Camphorquinone (2767-84-2,10334-26-6,10373-78-1,71074-96-9,105309-30-6,465-29-2)

Guidance literature:

With hydrogenchloride; formaldehyd; Heating;

DOI:10.1080/00397919908086451

upstream raw materials:

ethanol

3-(4-oxy-phenylimino)-camphor

water

sodium acetate

Downstream raw materials:

D-(+)-camphoric imide

bornane-2,3-dione-3-oxime-2-phenylhydrazone

(1R,2R,3S,4S)-3-Amino-1,7,7-trimethyl-bicyclo[2.2.1]heptan-2-ol

Camphorquinone