(1α,4α)-2-メチレン-3,3-ジメチルビシクロ[2.2.1]ヘプタン

(-)-Camphene

HCID 440966
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基本情報

CAS
5794-04-7
標準SMILES
C=C1[C@@H]2CC[C@@H](C2)C1(C)C
InChIKey
CRPUJAZIXJMDBK-BDAKNGLRSA-N
分子式
C10H16
平均分子量
136.23 g/mol
単同位体質量
136.12520051

名称と識別子

優先名称
(-)-Camphene
IUPAC
(1S,4R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane
現地名
(1α,4α)-2-メチレン-3,3-ジメチルビシクロ[2.2.1]ヘプタン
英語名
(-)-Camphene
分子式
C10H16
分子量
136.23

名称と別名

(-)-campheneL-Camphene(-)-Comphene(1S,4R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptaneDTXSID3046538M5YAV509FNCAMPHENE, L-CHEBI:89CAMPHENE, (-)-(-)-(1S,4R)-camphene(1S)-2,2-Dimethyl-3-methylenebicyclo(2.2.1)heptaneDTXCID1026538
名称をさらに表示
(1S,4R)-2,2-ジメチル-3-メチレンノルボルナン(1R,4S)-3,3-ジメチル-2-メチレンビシクロ[2.2.1]ヘプタン(1S,4R)-2,2-ジメチル-3-メチレンビシクロ[2.2.1]ヘプタン(-)-カンフェン(1α,4α)-2-メチレン-3,3-ジメチルビシクロ[2.2.1]ヘプタン(1β,4β)-2,2-ジメチル-3-メチレンビシクロ[2.2.1]ヘプタン[1S,4R,(-)]-2,2-ジメチル-3-メチレンビシクロ[2.2.1]ヘプタン2,2-dimethyl-3-methylene-,(1S)-Bicyclo[2.2.1]heptaneBicyclo2.2.1heptane, 2,2-dimethyl-3-methylene-, (1S,4R)-[1S,4R,(-)]-2,2-Dimethyl-3-methylenebicyclo[2.2.1]heptane(-)-Camphene,95%(+/-)-Camphene, sum of camphene + fenchene(1S,4R)-2,2-Dimethyl-3-methylenenorbornane2-dimethyl-3-methylene-(1s)-bicyclo[2.2.1]heptan
EINECS 227-337-8(1S,4R)-2,2-dimethyl-3-methylenebicyclo[2.2.1]heptaneBicyclo(2.2.1)heptane, 2,2-dimethyl-3-methylene-, (1S,4R)-(1S)-2,2-Dimethyl-3-methylenebicyclo[2.2.1]heptaneBicyclo(2.2.1)heptane, 2,2-dimethyl-3-methylene-, (1S)-Bicyclo[2.2.1]heptane, 2,2-dimethyl-3-methylene-, (1S)-Bicyclo[2.2.1]heptane, 2,2-dimethyl-3-methylene-, (1S,4R)-(1S,4R)-6,6-DIMETHYL-5-METHYLIDENEBICYCLO(2.2.1)HEPTANE

データベース識別子

CAS
5794-04-7
PubChem CID
440966
DTXSID
DTXSID3046538
ChEMBL
CHEMBL506889
ChEBI
CHEBI:89
UNII
M5YAV509FN
EC Number
227-337-8
Nikkaji
J39.022D

物性

構造計算による物性

XLogP
3.3
極性表面積
0 Ų
水素結合供与体数
0
水素結合受容体数
0
回転可能結合数
0
重原子数
10

物理化学的性質

融点
36 · 36-38 °C(lit.)
沸点
157.5 · 157.5-158.5 °C(lit.)
比重(密度)
0.84 g/mL · 0.84 g/mL at 25 °C(lit.)
屈折率
1.4562 · 1.4562 (estimate)
闪点
98 °F · 98 °F
溶解性
Benzene (Slightly), Chloroform (Sparingly)

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H226 (56.2%): Flammable liquid and vapor [Warning Flammable liquids]；H228 (44.4%): Flammable solid [Danger Flammable solids]；H319 (75%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H400 (50%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]；H410 (72.5%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P210, P233, P240, P241, P242, P243, P264+P265, P273, P280, P303+P361+P353, P305+P351+P338, P337+P317, P370+P378, P391, P403+P235, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 160 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

危険有害性情報

Regulatory Information · 2 件

Chemical: Bicyclo[2.2.1]heptane, 2,2-dimethyl-3-methylene-, (1S)-

Bicyclo2.2.1heptane, 2,2-dimethyl-3-methylene-, (1S,4R)-: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to environment
Hazard Classes and CategoriesFlam. Liq. 3 (56.2%)；Flam. Sol. 2 (44.4%)；Eye Irrit. 2 (75%)；Aquatic Acute 1 (50%)；Aquatic Chronic 1 (72.5%)

法規制情報

Regulatory Information · 2 件

Chemical: Bicyclo[2.2.1]heptane, 2,2-dimethyl-3-methylene-, (1S)-

Bicyclo2.2.1heptane, 2,2-dimethyl-3-methylene-, (1S,4R)-: Does not have an individual approval but may be used under an appropriate group standard

安全データ

wgk
3
tsca
TSCA listed
rtecs
EX1055000
ridadr
UN 1325 4.1/PG 2
risk_code
11-10
化審法
(取消)優先評価化学物質

化学と産業

用途と製造

Household ProductsInformation on 2 consumer products that contain L-Camphene in the following categories is provided:；• Inside the Home
General Manufacturing InformationBicyclo[2.2.1]heptane, 2,2-dimethyl-3-methylene-, (1S,4R)-: ACTIVE
調製方法 · 1 件

純化方法Purify norbornane by fractionation through a Stedman column (see p. 11) at 100mm in a N2 atmosphere, crystallise it from EtOH and sublime it in a vacuum below its melting point. It is characterised by its camphenilone semicarbazone, m 217-218.5o, or camphor semicarbazone, m 236-238o. [NMR: Hana & Koch Chem Ber 111 2527 1978, Bartlett et al. Justus Liebigs Ann Chem 623 217 1959, Bain et al. J Am Chem Soc 72 3124 1950, Beilstein 5 IV 461.]

上流・下流製品情報

サプライヤー15 社

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]

補足説明

定義ChEBI: A camphene (2,2-dimethyl-3-methylenebicyclo[2.2.1]heptane) that has S configuration at position 1 and R configuration at position 4.

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CAS 5794-04-7 (-)-Camphene (HCID 440966)｜化工社