(1S,2R,6S,7R)-トリシクロ[5.2.1.02,6]デカ-3,8-ジエン

(1S,2R,6S,7R)-トリシクロ[5.2.1.02,6]デカ-3,8-ジエン · (3aR)-4α,7α-メタノ-3aα,4,7,7aα-テトラヒドロ-1H-インデン · (1β,2β,6β,7β)-トリシクロ[5.2.1.02,6]デカ-3,8-ジエン · (4α,7α)-3aα,4,7,7aα-テトラヒドロ-4,7-メタノ-1H-インデン · ジシクロペンタジエン(エンド) · (3aR)-3aα,4,7,7aα-テトラヒドロ-4α,7α-メタノ-1H-インデン · 3aα,4,7,7aα-テトラヒドロ-4α,7α-メタノ-1H-インデン · (3aα,4α,7α,7aα)-3a,4,7,7a-テトラヒドロ-4,7-メタノ-1H-インデン

https://huagongshe.com/ja/chemical/6492

(1S,2R,6S,7R)-トリシクロ[5.2.1.02,6]デカ-3,8-ジエンの分子構造式

識別子と物理属性

CAS No.	1755-01-7
分子式	C10H12
平均分子量	132.2 g/mol
単同位体質量	132.09390038 g/mol
SMILES	C1=CC2C3C=CC(C3)C2C1
InChIKey	HECLRDQVFMWTQS-UHFFFAOYSA-N
PubChem CID	6492
ChEMBL	CHEMBL1570502
ChEBI	CHEBI:34695
EC No.	201-052-9
DTXSID	DTXSID5025023
現地名	(1S,2R,6S,7R)-トリシクロ[5.2.1.02,6]デカ-3,8-ジエン

化学・物理的性質

XLogP	2.5
極性表面積	0
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
形式電荷	0
複雑度	212
物質分類	Other Classes -> Aliphatics, UnsaturatedFlammable agents - 3rd degree
SpringerMaterials Properties	Density
農薬	Plant Growth RegulatorsActive substance -> EU Pesticides database: Not approved
LogP（分配係数）	log Kow = 2.78
臭い	Disagreeable camphor-like odorDisagreeable odor similar to that of camphorSweet, sharp odor, unpleasant
密度	0.978 at 68 °F (USCG, 1999) - Less dense than waterwill float0.9302 g/cu cm at 35 °CBulk density = 8.2 lb/gal at 60 °FLiquid density: 0.978 at 20 °C0.98 g/cm³Relative density of the vapour/air-mixture at 20 °C (air = 1): 1.01
Color/Form	Colorless crystalline solid [Note: A liquid above 90 degrees F]
溶解度	Insoluble (NTP, 1992)In water, 0.020 g/L at 25 °CVery soluble in ethyl ether, ethanolReadily sol in acetone, dichloromethane, ethyl acetate, n-hexane, and toluene.Solubility in water, g/100ml at 25 °C: 0.0020.02%
Corrosivity	Non-corrosive
引火点	90 °F (NTP, 1992)32 °C24 °C (75 °F)90 °F (32 °C) (Open cup)32 °C o.c.90 °F (open cup)
沸点	342 °F at 760 mmHg (NTP, 1992)172 °C166.6 °C @760 [mm Hg]179.15°C (rough estimate)
Decomposition	... /Dicyclopentadiene/ decomposes on heating above 170 °C.When heated to decomposition it emits acrid smoke and fumes.170-172 °C
融点	32°C
屈折率	1.5050

安全性と法規制

GHS 分類	DangerH225: Highly Flammable liquid and vapor [Danger Flammable liquids]P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)H225 (74%): Highly Flammable liquid and vapor [Danger Flammable liquids]P203, P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P272, P273, P280, P284, P301+P316, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P316, P317, P318, P319, P320, P321, P330, P331, P332+P317, P333+P317, P337+P317, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
規制情報	Chemical: 4,7-Methano-1H-indene, 3a,4,7,7a-tetrahydro-4,7-Methano-1H-indene, 3a,4,7,7a-tetrahydro- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 4,7-Methano-1H-indene, 3a,4,7,7a-tetrahydro- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)2002/2076Status: Active Update: 17-05-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/154124,7-Methano-1H-indene, 3a,4,7,7a-tetrahydro-: HSNO Approval: HSR001123 Approved with controlsThe New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
輸送ラベル（DOT）	Flammable Liquid
火災危険	FLAMMABLE. Flashback along vapor trail may occur. Vapor may explode if ignited in an enclosed area. (USCG, 1999)· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.Flammable. Above 32 °C explosive vapour/air mixtures may be formed.
火災の可能性	Flammablefire hazardDangerous fire hazard when exposed to heat or flame...
健康有害性	LIQUID OR SOLID: Irritating to skin and eyes. (USCG, 1999)· May cause toxic effects if inhaled or absorbed through skin.