ChemicalBook--->CAS DataBase List--->1335-66-6

1335-66-6

1335-66-6 Structure

1335-66-6 Structure
IdentificationBack Directory
[Name]

ISOCYCLOCITRAL
[CAS]

1335-66-6
[Synonyms]

xene
1335-66-6
ISOCYCLOCITRAL
Einecs 215-638-7
xene-1-carboxaldehyde
ISOCYCLOCITRAL USP/EP/BP
Isocyclocitral(mixture of isomers)
3,5,6-triMethylcyclohex-3-enecarbaldehyde
4,5,6-Trimethyl-3-cyclohexene-1-carbaldehyde
3-CYCLOHEXENE-1-CARBOXALDEHYDE, 2,4,6-TRIMETHYL
1-formyl-3,5,6-trimethyl-3-cyclohexeneand1-formyl-2,4,6-trimethyl-3-cyclohe
3-cyclohexene-1-carboxaldehyde,2,4,6-trimethyl-,and3,5,6-trimethyl-3-cyclohe
1-Formyl-3,5,6-trimethyl-3-cyclohexene and 1-formyl-2,4,6-trimethyl-3-cyclohexene
3-Cyclohexene-1-carboxaldehyde, 2,4,6-trimethyl-, and 3,5,6-trimethyl-3-cyclohexene-1-carboxaldehyde
[EINECS(EC#)]

215-638-7
[Molecular Formula]

C20H32O2
[MDL Number]

MFCD00466861
[MOL File]

1335-66-6.mol
[Molecular Weight]

304.47
Chemical PropertiesBack Directory
[Odor]

at 100.00 %. green aldehydic earthy woody herbal leaf
[Odor Type]

green
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

InChI=1S/2C10H16O/c1-7-4-8(2)9(3)10(5-7)6-11;1-7-4-8(2)10(6-11)9(3)5-7/h2*4,6,8-10H,5H2,1-3H3
[InChIKey]

AEXLFXYEFLKADK-UHFFFAOYSA-N
[SMILES]

C1(C=O)C(C)C=C(C)CC1C.C1(C=O)CC(=CC(C)C1C)C
[LogP]

2.870
[EPA Substance Registry System]

Isocyclocitral (1335-66-6)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H319-H315-H317-H412
[Precautionary statements ]

P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P273-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
[TSCA ]

TSCA listed
[Toxicity]

The acute oral LD50 value in rats was reported to be 4.5 ml/kg (4.16-4.86 ml/kg) (Levenstein, 1973a). The acute dermal LD50 value was reported to be > 5 ml/kg in the rabbit(Levenstein, 1973b).
Hazard InformationBack Directory
[Description]

Reported in several of the NAS food additive surveys, but no technical effect (food functionality) given.
[Chemical Properties]

iso-CYCLOCITRAL is a colorless liquid. Insoluble in water, soluble in alcohol and oils. Sp.Gr. 0.93. Powerful, and diffusive, foliage-green, "dark"-weedy and dry odor, sometimes described as "Flower-shop odor". The earthy and wet-green notes are quite natural in high dilution and resemble the odor of stems from plants and flowers fresh from the soil.
[Occurrence]

Has apparently not been reported to occur in nature
[Uses]

iso-CYCLOCITRAL finds use in perfume compositions where it blends excellently with Oakmoss products (compensates for sweetness and lifts the topnote), with Ionones (freshness), Geranium and Galbanum (enhances the green and “vegetable” notes), etc.
[Definition]

ChEBI: Isocyclocitral is an organooxygen compound.
[Preparation]

By a Diels-Alder-type condensation of 2-methyl-l,3-pentadiene with crotonaldehyde(Bedoukian, 1967).
1335-66-6 suppliers list
Company Name: jiliang chemicals  
Telephone: 21-62165282
Website: http://www.jiliangchem.com
Company Name: Beijing Isomersyn Technology CO;LTD  
Telephone: 010-82954736 13391601435
Website: www.chemicalbook.com/supplier/10680452/1.htm
Company Name: Syntechem Co.,Ltd  
Telephone:
Website: www.syntechem.com
Company Name: Chengdu Ai Keda Chemical Technology Co., Ltd.  
Telephone: 4008-755-333 18080918076
Website: http://www.aikeshiji.com
Company Name: Beijing HuaMeiHuLiBiological Chemical   
Telephone: 010-56205725
Website: www.huabeibiochem.com
Company Name: Chengdu HuaXia Chemical Reagent Co. Ltd  
Telephone: 400-1166-196 13458535857
Website: http://www.hx-r.com
Company Name: Shandong Xiya Chemical Co., Ltd.  
Telephone: 4009903999 13395398332
Website: http://www.xiyashiji.com
Company Name: ShangHai Biochempartner Co.,Ltd  
Telephone: 177-54423994 17754423994
Website: www.biochempartner.com
Company Name: Shanghai Orgchem Co.,Ltd.  
Telephone: +86-21-5877 1921
Website: www.chemofchina.com
Company Name: Shanghai Shuai Sun Industrial Co., Ltd.  
Telephone: 021-37590756 57450129
Website: www.shsschem.com:8002/home/index
Company Name: Chengdu Saint - Kay Biotechnology Co., Ltd.  
Telephone: 028-85157043 15882256948
Website: https://www.chemicalbook.com/ShowSupplierProductsList30701/0_EN.htm
Company Name: Zhengzhou Acme Chemical Co., Ltd.  
Telephone: 037163312495 13303845143
Website: www.acmechem.cn
Company Name: SHANDONG ZHI SHANG CHEMICAL CO.LTD  
Telephone: 0531-68652808 18953170293
Website: www.zhishangchem.com/
Company Name: Tianjin Kaifu Pharmaceutical Technology Co., Ltd.  
Telephone: 18081075745
Website: www.chemicalbook.com/ShowSupplierProductsList31177/0_EN.htm
Company Name: Shanghai Dingfen Chemical Technology Co., Ltd.  
Telephone: 021-37590756
Website: karmachem.cn/shop/home.do
Company Name: ShanDong Look Chemical Co.,Ltd.  
Telephone: 17653113209 13065062079
Website: https://www.sdlookchem.com/
Company Name: Shandong Zhishang New Material Co., Ltd.  
Telephone: +8617653113209
Website: https://www.zhishangchemical.com/
Company Name: ANHUI WITOP BIOTECH CO., LTD  
Telephone: +8618071025641
Website: www.chemicalbook.com/ShowSupplierProductsList418627/0_EN.htm
Tags:1335-66-6 Related Product Information
23787-90-8 37677-14-8 5392-40-5 100-50-5