3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one

Modify Date: 2025-09-22 13:03:27

3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one Structure
3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one structure
 Common Name 3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one
CAS Number 889-31-6 Molecular Weight 229.31700
Density 1.05g/cm3 Boiling Point 367ºC at 760 mmHg
Molecular Formula C15H19NO Melting Point N/A
MSDS N/A Flash Point 135.6ºC

 Names

Name 3-(benzylamino)-5,5-dimethylcyclohex-2-en-1-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.05g/cm3
Boiling Point 367ºC at 760 mmHg
Molecular Formula C15H19NO
Molecular Weight 229.31700
Flash Point 135.6ºC
Exact Mass 229.14700
PSA 29.10000
LogP 3.44010
Index of Refraction 1.555
InChIKey CCAHMSNAFCNUPX-UHFFFAOYSA-N
SMILES CC1(C)CC(=O)C=C(NCc2ccccc2)C1

 Safety Information

HS Code 2922399090

 Synthetic Route

Dimedone structure

Dimedone

CAS#:126-81-8

Benzylamine structure

Benzylamine

CAS#:100-46-9

~99%

3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one Structure

3-(benzylamino)...

CAS#:889-31-6

Literature: Chanda, Kaushik; Dutta, Milan Chandra; Vishwakarma Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 2004 , vol. 43, # 11 p. 2475 - 2477
5,5-Dimethyl-cyclohex-2-enone-3-ol structure

5,5-Dimethyl-cy...

CAS#:3471-13-4

Benzylamine structure

Benzylamine

CAS#:100-46-9

~87%

3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one Structure

3-(benzylamino)...

CAS#:889-31-6

Literature: Amougay, Aicha; Pete, Jean-Pierre; Piva, Olivier Bulletin de la Societe Chimique de France, 1996 , vol. 133, # 6 p. 625 - 635
2-[(4,4-dimethyl-2,6-dioxo-cyclohexyl)-(4-methoxyphenyl)methyl]-5,5-dimethyl-cyclohexane-1,3-dione structure

2-[(4,4-dimethy...

CAS#:19419-24-0

Benzylamine structure

Benzylamine

CAS#:100-46-9

~41%

3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one Structure

3-(benzylamino)...

CAS#:889-31-6

Literature: Nikolaeva; Shchekotikhin; Ponomarev; Kriven'ko Chemistry of Heterocyclic Compounds, 2000 , vol. 36, # 4 p. 403 - 409
N/A structure

N/A

CAS#:69370-88-3

~0%

3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one Structure

3-(benzylamino)...

CAS#:889-31-6

2,2'-Methylen-bis(3-benzylamino-5,5-dimethyl-2-cyclohexen-1-on) structure

2,2'-Methylen-b...

CAS#:76159-32-5

Literature: Moehrle, H.; Herbke, J. Pharmazie, 1980 , vol. 35, # 7 p. 389 - 393
(1R,4R)-(-)-4-hydroxy-p-menth-3-one structure

(1R,4R)-(-)-4-h...

CAS#:76159-25-6

~0%

3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one Structure

3-(benzylamino)...

CAS#:889-31-6

2,2'-Methylen-bis(3-benzylamino-5,5-dimethyl-2-cyclohexen-1-on) structure

2,2'-Methylen-b...

CAS#:76159-32-5

Literature: Moehrle, H.; Herbke, J. Pharmazie, 1980 , vol. 35, # 7 p. 389 - 393
Benzyl bromide structure

Benzyl bromide

CAS#:100-39-0

5,5-Dimethyl-3-aminocyclohex-2-enone structure

5,5-Dimethyl-3-...

CAS#:873-95-0

~%

3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one Structure

3-(benzylamino)...

CAS#:889-31-6

2-benzyl-3-benzylamino-5,5-dimethylcyclohex-2-enone structure

2-benzyl-3-benz...

CAS#:89229-78-7

Literature: Greenhill, John V.; Moten, Ashraf M. Tetrahedron, 1983 , vol. 39, # 20 p. 3405 - 3408
Formic Acid structure

Formic Acid

CAS#:64-18-6

3,3,6,6,9-pentamethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione structure

3,3,6,6,9-penta...

CAS#:19225-63-9

Benzylamine structure

Benzylamine

CAS#:100-46-9

~37%

3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one Structure

3-(benzylamino)...

CAS#:889-31-6

Literature: Shchekotikhin; Nikolaeva Chemistry of Heterocyclic Compounds, 2006 , vol. 42, # 1 p. 28 - 33
Formic Acid structure

Formic Acid

CAS#:64-18-6

3,3,6,6-tetramethyl-9-phenyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8-(2H)-dione structure

3,3,6,6-tetrame...

CAS#:19744-83-3

Benzylamine structure

Benzylamine

CAS#:100-46-9

~38%

3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one Structure

3-(benzylamino)...

CAS#:889-31-6

Literature: Shchekotikhin; Nikolaeva Chemistry of Heterocyclic Compounds, 2006 , vol. 42, # 1 p. 28 - 33
Formic Acid structure

Formic Acid

CAS#:64-18-6

9-(4-methoxyphenyl)-3,3,6,6-tetramethyl-2,3,4,5,6,7,8,9-octahydro-1H-xanthene-1,8-dione structure

9-(4-methoxyphe...

CAS#:19419-25-1

Benzylamine structure

Benzylamine

CAS#:100-46-9

~40%

3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one Structure

3-(benzylamino)...

CAS#:889-31-6

Literature: Shchekotikhin; Nikolaeva Chemistry of Heterocyclic Compounds, 2006 , vol. 42, # 1 p. 28 - 33

 Customs

HS Code 2922399090
Summary 2922399090 other amino-aldehydes, amino-ketones and amino-quinones, other than those containing more than one kind of oxygen function; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

5,5-dimethyl-3-benzylamino-2-cyclohexen-1-one
3-Benzylamino-5,5-dimethyl-2-cyclohexen-1-on
3-benzylamino-5,5-dimethylcyclohex-2-en-1-one
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Chemsrc provides CAS#:889-31-6 MSDS, density, melting point, boiling point, structure, etc. Its name is 3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one>> amp version: 3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one

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